# Electronic Supplementary Material (ESI) for Physical Chemistry Chemical Physics.
# This journal is © the Owner Societies 2014

data_3D\Atomistic
_audit_creation_date              2012-09-24
_audit_creation_method            'Materials Studio'
_symmetry_space_group_name_H-M    'P1'
_symmetry_Int_Tables_number       1
_symmetry_cell_setting            triclinic
loop_
_symmetry_equiv_pos_as_xyz
  x,y,z
_cell_length_a                    150.0000
_cell_length_b                    150.0000
_cell_length_c                    150.0000
_cell_angle_alpha                 90.0000
_cell_angle_beta                  90.0000
_cell_angle_gamma                 90.0000
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
C1     C     0.43772   0.54007  -0.45953   0.00000  Uiso   1.00
C2     C     0.42971   0.53505  -0.45811   0.00000  Uiso   1.00
C3     C     0.42958   0.52596  -0.45884   0.00000  Uiso   1.00
C4     C     0.43754   0.52124  -0.46109   0.00000  Uiso   1.00
C5     C     0.44560   0.52610  -0.46245   0.00000  Uiso   1.00
C6     C     0.44566   0.53518  -0.46166   0.00000  Uiso   1.00
H7     H     0.42327   0.52239  -0.45776   0.00000  Uiso   1.00
H8     H     0.45184   0.52267  -0.46421   0.00000  Uiso   1.00
C9     C     0.43779   0.54966  -0.45911   0.00000  Uiso   1.00
C10    C     0.44550   0.55440  -0.45605   0.00000  Uiso   1.00
C11    C     0.44583   0.56352  -0.45611   0.00000  Uiso   1.00
C12    C     0.43840   0.56854  -0.45928   0.00000  Uiso   1.00
C13    C     0.43060   0.56396  -0.46220   0.00000  Uiso   1.00
C14    C     0.43032   0.55484  -0.46207   0.00000  Uiso   1.00
H15    H     0.42347   0.53852  -0.45639   0.00000  Uiso   1.00
H16    H     0.45194   0.53875  -0.46293   0.00000  Uiso   1.00
H17    H     0.45137   0.55071  -0.45365   0.00000  Uiso   1.00
H18    H     0.45194   0.56685  -0.45382   0.00000  Uiso   1.00
H19    H     0.42477   0.56765  -0.46470   0.00000  Uiso   1.00
H20    H     0.42430   0.55148  -0.46459   0.00000  Uiso   1.00
C21    C     0.46766   0.48627  -0.47534   0.00000  Uiso   1.00
C22    C     0.46774   0.49556  -0.47313   0.00000  Uiso   1.00
C23    C     0.46044   0.49974  -0.46963   0.00000  Uiso   1.00
C24    C     0.45246   0.49484  -0.46807   0.00000  Uiso   1.00
C25    C     0.45239   0.48547  -0.46971   0.00000  Uiso   1.00
C26    C     0.45980   0.48137  -0.47313   0.00000  Uiso   1.00
C27    C     0.44474   0.49922  -0.46551   0.00000  Uiso   1.00
N28    N     0.43732   0.49425  -0.46448   0.00000  Uiso   1.00
C29    C     0.42997   0.49890  -0.46215   0.00000  Uiso   1.00
N30    N     0.42961   0.50780  -0.46088   0.00000  Uiso   1.00
C31    C     0.43744   0.51207  -0.46215   0.00000  Uiso   1.00
N32    N     0.44521   0.50814  -0.46444   0.00000  Uiso   1.00
H33    H     0.46073   0.50696  -0.46841   0.00000  Uiso   1.00
H34    H     0.44635   0.48149  -0.46857   0.00000  Uiso   1.00
H35    H     0.47354   0.49976  -0.47475   0.00000  Uiso   1.00
H36    H     0.45936   0.47418  -0.47455   0.00000  Uiso   1.00
C37    C     0.40654   0.48400  -0.45776   0.00000  Uiso   1.00
C38    C     0.41464   0.47982  -0.46066   0.00000  Uiso   1.00
C39    C     0.42220   0.48466  -0.46221   0.00000  Uiso   1.00
C40    C     0.42219   0.49409  -0.46097   0.00000  Uiso   1.00
C41    C     0.41414   0.49842  -0.45831   0.00000  Uiso   1.00
C42    C     0.40661   0.49350  -0.45680   0.00000  Uiso   1.00
H43    H     0.42828   0.48116  -0.46431   0.00000  Uiso   1.00
H44    H     0.41392   0.50568  -0.45733   0.00000  Uiso   1.00
H45    H     0.41498   0.47253  -0.46135   0.00000  Uiso   1.00
H46    H     0.40053   0.49702  -0.45465   0.00000  Uiso   1.00
C47    C     0.47151   0.60278  -0.45274   0.00000  Uiso   1.00
C48    C     0.46397   0.60798  -0.45557   0.00000  Uiso   1.00
C49    C     0.45584   0.60410  -0.45703   0.00000  Uiso   1.00
C50    C     0.45468   0.59475  -0.45564   0.00000  Uiso   1.00
C51    C     0.46200   0.58956  -0.45246   0.00000  Uiso   1.00
C52    C     0.47010   0.59346  -0.45107   0.00000  Uiso   1.00
H53    H     0.45032   0.60822  -0.45953   0.00000  Uiso   1.00
H54    H     0.46132   0.58234  -0.45134   0.00000  Uiso   1.00
H55    H     0.46482   0.61513  -0.45698   0.00000  Uiso   1.00
H56    H     0.47570   0.58927  -0.44886   0.00000  Uiso   1.00
C57    C     0.43888   0.57775  -0.45974   0.00000  Uiso   1.00
N58    N     0.43174   0.58213  -0.46301   0.00000  Uiso   1.00
C59    C     0.43267   0.59108  -0.46340   0.00000  Uiso   1.00
N60    N     0.44002   0.59569  -0.46097   0.00000  Uiso   1.00
C61    C     0.44676   0.59058  -0.45788   0.00000  Uiso   1.00
N62    N     0.44654   0.58161  -0.45704   0.00000  Uiso   1.00
C63    C     0.41071   0.60550  -0.47358   0.00000  Uiso   1.00
C64    C     0.41070   0.59597  -0.47317   0.00000  Uiso   1.00
C65    C     0.41775   0.59129  -0.46978   0.00000  Uiso   1.00
C66    C     0.42549   0.59586  -0.46669   0.00000  Uiso   1.00
C67    C     0.42569   0.60537  -0.46709   0.00000  Uiso   1.00
C68    C     0.41850   0.60996  -0.47033   0.00000  Uiso   1.00
H69    H     0.41738   0.58396  -0.46964   0.00000  Uiso   1.00
H70    H     0.43154   0.60910  -0.46473   0.00000  Uiso   1.00
H71    H     0.40502   0.59210  -0.47573   0.00000  Uiso   1.00
H72    H     0.41889   0.61729  -0.47040   0.00000  Uiso   1.00
C73    C     0.54942   0.59548  -0.46889   0.00000  Uiso   1.00
C74    C     0.54966   0.58594  -0.46942   0.00000  Uiso   1.00
C75    C     0.55652   0.58160  -0.47355   0.00000  Uiso   1.00
C76    C     0.56356   0.58655  -0.47760   0.00000  Uiso   1.00
C77    C     0.56342   0.59605  -0.47722   0.00000  Uiso   1.00
C78    C     0.55658   0.60032  -0.47298   0.00000  Uiso   1.00
H79    H     0.55644   0.57427  -0.47377   0.00000  Uiso   1.00
H80    H     0.56874   0.60002  -0.48033   0.00000  Uiso   1.00
C81    C     0.54229   0.60000  -0.46435   0.00000  Uiso   1.00
C82    C     0.54389   0.60809  -0.45952   0.00000  Uiso   1.00
C83    C     0.53714   0.61252  -0.45531   0.00000  Uiso   1.00
C84    C     0.52822   0.60924  -0.45581   0.00000  Uiso   1.00
C85    C     0.52650   0.60114  -0.46049   0.00000  Uiso   1.00
C86    C     0.53333   0.59666  -0.46453   0.00000  Uiso   1.00
H87    H     0.54436   0.58195  -0.46631   0.00000  Uiso   1.00
H88    H     0.55659   0.60766  -0.47284   0.00000  Uiso   1.00
H89    H     0.55069   0.61082  -0.45908   0.00000  Uiso   1.00
H90    H     0.53868   0.61874  -0.45174   0.00000  Uiso   1.00
H91    H     0.51970   0.59842  -0.46090   0.00000  Uiso   1.00
H92    H     0.53179   0.59048  -0.46817   0.00000  Uiso   1.00
C93    C     0.60323   0.59712  -0.50305   0.00000  Uiso   1.00
C94    C     0.59614   0.60142  -0.49833   0.00000  Uiso   1.00
C95    C     0.58957   0.59664  -0.49421   0.00000  Uiso   1.00
C96    C     0.58964   0.58712  -0.49455   0.00000  Uiso   1.00
C97    C     0.59658   0.58270  -0.49931   0.00000  Uiso   1.00
C98    C     0.60310   0.58756  -0.50343   0.00000  Uiso   1.00
C99    C     0.58306   0.58230  -0.49025   0.00000  Uiso   1.00
N100   N     0.58343   0.57330  -0.49071   0.00000  Uiso   1.00
C101   C     0.57676   0.56910  -0.48639   0.00000  Uiso   1.00
N102   N     0.57006   0.57316  -0.48195   0.00000  Uiso   1.00
C103   C     0.57038   0.58213  -0.48197   0.00000  Uiso   1.00
N104   N     0.57673   0.58708  -0.48596   0.00000  Uiso   1.00
H105   H     0.58430   0.60026  -0.49062   0.00000  Uiso   1.00
H106   H     0.59681   0.57538  -0.49969   0.00000  Uiso   1.00
H107   H     0.59593   0.60874  -0.49789   0.00000  Uiso   1.00
H108   H     0.60848   0.58394  -0.50684   0.00000  Uiso   1.00
C109   C     0.57476   0.54108  -0.48769   0.00000  Uiso   1.00
C110   C     0.58209   0.54565  -0.49175   0.00000  Uiso   1.00
C111   C     0.58296   0.55474  -0.49123   0.00000  Uiso   1.00
C112   C     0.57650   0.55987  -0.48651   0.00000  Uiso   1.00
C113   C     0.56940   0.55538  -0.48207   0.00000  Uiso   1.00
C114   C     0.56866   0.54633  -0.48259   0.00000  Uiso   1.00
H115   H     0.58853   0.55800  -0.49471   0.00000  Uiso   1.00
H116   H     0.56432   0.55909  -0.47829   0.00000  Uiso   1.00
H117   H     0.58698   0.54194  -0.49577   0.00000  Uiso   1.00
H118   H     0.56302   0.54320  -0.47909   0.00000  Uiso   1.00
C119   C     0.52374   0.64878  -0.42911   0.00000  Uiso   1.00
C120   C     0.51456   0.64630  -0.43021   0.00000  Uiso   1.00
C121   C     0.51214   0.63891  -0.43497   0.00000  Uiso   1.00
C122   C     0.51884   0.63346  -0.43898   0.00000  Uiso   1.00
C123   C     0.52802   0.63576  -0.43789   0.00000  Uiso   1.00
C124   C     0.53038   0.64306  -0.43301   0.00000  Uiso   1.00
H125   H     0.50503   0.63727  -0.43571   0.00000  Uiso   1.00
H126   H     0.53333   0.63168  -0.44087   0.00000  Uiso   1.00
H127   H     0.50936   0.65057  -0.42731   0.00000  Uiso   1.00
H128   H     0.53748   0.64482  -0.43249   0.00000  Uiso   1.00
C129   C     0.52133   0.61401  -0.45196   0.00000  Uiso   1.00
N130   N     0.51296   0.61093  -0.45302   0.00000  Uiso   1.00
C131   C     0.50654   0.61607  -0.44930   0.00000  Uiso   1.00
N132   N     0.50796   0.62368  -0.44466   0.00000  Uiso   1.00
C133   C     0.51664   0.62594  -0.44386   0.00000  Uiso   1.00
N134   N     0.52356   0.62143  -0.44744   0.00000  Uiso   1.00
C135   C     0.48027   0.60651  -0.45217   0.00000  Uiso   1.00
C136   C     0.48777   0.60172  -0.45569   0.00000  Uiso   1.00
C137   C     0.49624   0.60492  -0.45489   0.00000  Uiso   1.00
C138   C     0.49786   0.61314  -0.45036   0.00000  Uiso   1.00
C139   C     0.49049   0.61810  -0.44691   0.00000  Uiso   1.00
C140   C     0.48198   0.61494  -0.44792   0.00000  Uiso   1.00
H141   H     0.50177   0.60094  -0.45762   0.00000  Uiso   1.00
H142   H     0.49155   0.62448  -0.44345   0.00000  Uiso   1.00
H143   H     0.48673   0.59529  -0.45909   0.00000  Uiso   1.00
H144   H     0.47638   0.61879  -0.44516   0.00000  Uiso   1.00
C145   C     0.53940   0.49647  -0.50867   0.00000  Uiso   1.00
C146   C     0.54793   0.49248  -0.51037   0.00000  Uiso   1.00
C147   C     0.55542   0.49755  -0.51150   0.00000  Uiso   1.00
C148   C     0.55486   0.50704  -0.51109   0.00000  Uiso   1.00
C149   C     0.54646   0.51115  -0.50943   0.00000  Uiso   1.00
C150   C     0.53902   0.50602  -0.50819   0.00000  Uiso   1.00
H151   H     0.56182   0.49420  -0.51274   0.00000  Uiso   1.00
H152   H     0.54585   0.51844  -0.50904   0.00000  Uiso   1.00
C153   C     0.53156   0.49108  -0.50753   0.00000  Uiso   1.00
C154   C     0.52470   0.49353  -0.50134   0.00000  Uiso   1.00
C155   C     0.51732   0.48832  -0.50010   0.00000  Uiso   1.00
C156   C     0.51610   0.48047  -0.50534   0.00000  Uiso   1.00
C157   C     0.52282   0.47793  -0.51157   0.00000  Uiso   1.00
C158   C     0.53031   0.48304  -0.51255   0.00000  Uiso   1.00
H159   H     0.54856   0.48518  -0.51068   0.00000  Uiso   1.00
H160   H     0.53260   0.50936  -0.50697   0.00000  Uiso   1.00
H161   H     0.52538   0.49964  -0.49733   0.00000  Uiso   1.00
H162   H     0.51224   0.49046  -0.49527   0.00000  Uiso   1.00
H163   H     0.52206   0.47193  -0.51571   0.00000  Uiso   1.00
H164   H     0.53536   0.48096  -0.51745   0.00000  Uiso   1.00
C165   C     0.56606   0.55354  -0.50987   0.00000  Uiso   1.00
C166   C     0.55862   0.54760  -0.50991   0.00000  Uiso   1.00
C167   C     0.55962   0.53865  -0.51118   0.00000  Uiso   1.00
C168   C     0.56826   0.53495  -0.51269   0.00000  Uiso   1.00
C169   C     0.57574   0.54082  -0.51325   0.00000  Uiso   1.00
C170   C     0.57462   0.54980  -0.51189   0.00000  Uiso   1.00
C171   C     0.56915   0.52577  -0.51313   0.00000  Uiso   1.00
N172   N     0.57733   0.52220  -0.51445   0.00000  Uiso   1.00
C173   C     0.57742   0.51318  -0.51453   0.00000  Uiso   1.00
N174   N     0.57021   0.50788  -0.51346   0.00000  Uiso   1.00
C175   C     0.56244   0.51218  -0.51224   0.00000  Uiso   1.00
N176   N     0.56151   0.52110  -0.51199   0.00000  Uiso   1.00
H177   H     0.55367   0.53440  -0.51081   0.00000  Uiso   1.00
H178   H     0.58248   0.53818  -0.51442   0.00000  Uiso   1.00
H179   H     0.55182   0.55007  -0.50867   0.00000  Uiso   1.00
H180   H     0.58058   0.55407  -0.51193   0.00000  Uiso   1.00
C181   C     0.60096   0.49902  -0.52044   0.00000  Uiso   1.00
C182   C     0.60104   0.50860  -0.51996   0.00000  Uiso   1.00
C183   C     0.59353   0.51334  -0.51775   0.00000  Uiso   1.00
C184   C     0.58541   0.50876  -0.51585   0.00000  Uiso   1.00
C185   C     0.58540   0.49923  -0.51574   0.00000  Uiso   1.00
C186   C     0.59295   0.49460  -0.51779   0.00000  Uiso   1.00
H187   H     0.59375   0.52066  -0.51784   0.00000  Uiso   1.00
H188   H     0.57932   0.49544  -0.51419   0.00000  Uiso   1.00
H189   H     0.60704   0.51229  -0.52203   0.00000  Uiso   1.00
H190   H     0.59256   0.48728  -0.51789   0.00000  Uiso   1.00
C191   C     0.47480   0.48234  -0.48053   0.00000  Uiso   1.00
C192   C     0.47330   0.47484  -0.48627   0.00000  Uiso   1.00
C193   C     0.47972   0.47181  -0.49199   0.00000  Uiso   1.00
C194   C     0.48818   0.47615  -0.49239   0.00000  Uiso   1.00
C195   C     0.48988   0.48346  -0.48655   0.00000  Uiso   1.00
C196   C     0.48344   0.48632  -0.48079   0.00000  Uiso   1.00
H197   H     0.47818   0.46616  -0.49641   0.00000  Uiso   1.00
H198   H     0.49635   0.48692  -0.48663   0.00000  Uiso   1.00
H199   H     0.46673   0.47158  -0.48649   0.00000  Uiso   1.00
H200   H     0.48507   0.49202  -0.47647   0.00000  Uiso   1.00
C201   C     0.50825   0.47564  -0.50473   0.00000  Uiso   1.00
N202   N     0.50716   0.46876  -0.51042   0.00000  Uiso   1.00
C203   C     0.49921   0.46460  -0.50979   0.00000  Uiso   1.00
N204   N     0.49266   0.46668  -0.50397   0.00000  Uiso   1.00
C205   C     0.49458   0.47357  -0.49851   0.00000  Uiso   1.00
N206   N     0.50222   0.47835  -0.49864   0.00000  Uiso   1.00
C207   C     0.49414   0.44400  -0.52829   0.00000  Uiso   1.00
C208   C     0.50246   0.44866  -0.52818   0.00000  Uiso   1.00
C209   C     0.50419   0.45526  -0.52214   0.00000  Uiso   1.00
C210   C     0.49760   0.45773  -0.51574   0.00000  Uiso   1.00
C211   C     0.48925   0.45320  -0.51574   0.00000  Uiso   1.00
C212   C     0.48764   0.44660  -0.52182   0.00000  Uiso   1.00
H213   H     0.51068   0.45865  -0.52237   0.00000  Uiso   1.00
H214   H     0.48400   0.45496  -0.51093   0.00000  Uiso   1.00
H215   H     0.50769   0.44710  -0.53307   0.00000  Uiso   1.00
H216   H     0.48112   0.44326  -0.52147   0.00000  Uiso   1.00
C217   C     0.36876   0.41360  -0.46030   0.00000  Uiso   1.00
C218   C     0.36738   0.40602  -0.45464   0.00000  Uiso   1.00
C219   C     0.36672   0.39758  -0.45803   0.00000  Uiso   1.00
C220   C     0.36725   0.39613  -0.46741   0.00000  Uiso   1.00
C221   C     0.36877   0.40357  -0.47316   0.00000  Uiso   1.00
C222   C     0.36949   0.41198  -0.46970   0.00000  Uiso   1.00
H223   H     0.36554   0.39198  -0.45343   0.00000  Uiso   1.00
H224   H     0.36917   0.40268  -0.48043   0.00000  Uiso   1.00
C225   C     0.36937   0.42246  -0.45670   0.00000  Uiso   1.00
C226   C     0.37539   0.42892  -0.46039   0.00000  Uiso   1.00
C227   C     0.37614   0.43729  -0.45687   0.00000  Uiso   1.00
C228   C     0.37082   0.43986  -0.44941   0.00000  Uiso   1.00
C229   C     0.36469   0.43359  -0.44571   0.00000  Uiso   1.00
C230   C     0.36406   0.42520  -0.44922   0.00000  Uiso   1.00
H231   H     0.36689   0.40693  -0.44737   0.00000  Uiso   1.00
H232   H     0.37048   0.41760  -0.47431   0.00000  Uiso   1.00
H233   H     0.37966   0.42710  -0.46608   0.00000  Uiso   1.00
H234   H     0.38094   0.44196  -0.45987   0.00000  Uiso   1.00
H235   H     0.36050   0.43537  -0.43995   0.00000  Uiso   1.00
H236   H     0.35928   0.42049  -0.44623   0.00000  Uiso   1.00
C237   C     0.36352   0.37600  -0.51101   0.00000  Uiso   1.00
C238   C     0.36592   0.38422  -0.50680   0.00000  Uiso   1.00
C239   C     0.36627   0.38504  -0.49775   0.00000  Uiso   1.00
C240   C     0.36422   0.37760  -0.49217   0.00000  Uiso   1.00
C241   C     0.36184   0.36932  -0.49621   0.00000  Uiso   1.00
C242   C     0.36142   0.36863  -0.50531   0.00000  Uiso   1.00
C243   C     0.36430   0.37862  -0.48300   0.00000  Uiso   1.00
N244   N     0.36238   0.37144  -0.47793   0.00000  Uiso   1.00
C245   C     0.36248   0.37303  -0.46905   0.00000  Uiso   1.00
N246   N     0.36415   0.38100  -0.46519   0.00000  Uiso   1.00
C247   C     0.36587   0.38770  -0.47095   0.00000  Uiso   1.00
N248   N     0.36611   0.38689  -0.47989   0.00000  Uiso   1.00
H249   H     0.36810   0.39153  -0.49487   0.00000  Uiso   1.00
H250   H     0.36017   0.36349  -0.49210   0.00000  Uiso   1.00
H251   H     0.36745   0.39016  -0.51082   0.00000  Uiso   1.00
H252   H     0.35957   0.36214  -0.50819   0.00000  Uiso   1.00
C253   C     0.35417   0.35254  -0.45173   0.00000  Uiso   1.00
C254   C     0.35503   0.35096  -0.46114   0.00000  Uiso   1.00
C255   C     0.35798   0.35748  -0.46681   0.00000  Uiso   1.00
C256   C     0.36042   0.36604  -0.46339   0.00000  Uiso   1.00
C257   C     0.36014   0.36753  -0.45399   0.00000  Uiso   1.00
C258   C     0.35714   0.36100  -0.44840   0.00000  Uiso   1.00
H259   H     0.35815   0.35614  -0.47401   0.00000  Uiso   1.00
H260   H     0.36203   0.37402  -0.45113   0.00000  Uiso   1.00
H261   H     0.35278   0.34456  -0.46397   0.00000  Uiso   1.00
H262   H     0.35669   0.36246  -0.44122   0.00000  Uiso   1.00
C263   C     0.39886   0.47876  -0.45534   0.00000  Uiso   1.00
C264   C     0.39307   0.48147  -0.44823   0.00000  Uiso   1.00
C265   C     0.38633   0.47610  -0.44526   0.00000  Uiso   1.00
C266   C     0.38491   0.46758  -0.44925   0.00000  Uiso   1.00
C267   C     0.39038   0.46490  -0.45655   0.00000  Uiso   1.00
C268   C     0.39709   0.47034  -0.45947   0.00000  Uiso   1.00
H269   H     0.38224   0.47836  -0.43962   0.00000  Uiso   1.00
H270   H     0.38942   0.45838  -0.45979   0.00000  Uiso   1.00
H271   H     0.39424   0.48782  -0.44475   0.00000  Uiso   1.00
H272   H     0.40130   0.46800  -0.46501   0.00000  Uiso   1.00
C273   C     0.37172   0.44830  -0.44577   0.00000  Uiso   1.00
N274   N     0.36653   0.45045  -0.43871   0.00000  Uiso   1.00
C275   C     0.36786   0.45876  -0.43549   0.00000  Uiso   1.00
N276   N     0.37380   0.46471  -0.43873   0.00000  Uiso   1.00
C277   C     0.37859   0.46182  -0.44577   0.00000  Uiso   1.00
N278   N     0.37783   0.45372  -0.44959   0.00000  Uiso   1.00
C279   C     0.35224   0.46741  -0.41372   0.00000  Uiso   1.00
C280   C     0.35119   0.45864  -0.41739   0.00000  Uiso   1.00
C281   C     0.35626   0.45575  -0.42440   0.00000  Uiso   1.00
C282   C     0.36278   0.46150  -0.42829   0.00000  Uiso   1.00
C283   C     0.36394   0.47024  -0.42470   0.00000  Uiso   1.00
C284   C     0.35886   0.47304  -0.41768   0.00000  Uiso   1.00
H285   H     0.35522   0.44897  -0.42700   0.00000  Uiso   1.00
H286   H     0.36888   0.47486  -0.42753   0.00000  Uiso   1.00
H287   H     0.34623   0.45405  -0.41454   0.00000  Uiso   1.00
H288   H     0.35982   0.47989  -0.41522   0.00000  Uiso   1.00
C289   C     0.37978   0.66118  -0.50842   0.00000  Uiso   1.00
C290   C     0.37192   0.65608  -0.51032   0.00000  Uiso   1.00
C291   C     0.37102   0.64744  -0.50753   0.00000  Uiso   1.00
C292   C     0.37799   0.64324  -0.50259   0.00000  Uiso   1.00
C293   C     0.38596   0.64813  -0.50081   0.00000  Uiso   1.00
C294   C     0.38676   0.65678  -0.50361   0.00000  Uiso   1.00
H295   H     0.36478   0.64387  -0.50901   0.00000  Uiso   1.00
H296   H     0.39146   0.64510  -0.49703   0.00000  Uiso   1.00
C297   C     0.38056   0.67040  -0.51104   0.00000  Uiso   1.00
C298   C     0.38550   0.67665  -0.50575   0.00000  Uiso   1.00
C299   C     0.38628   0.68540  -0.50816   0.00000  Uiso   1.00
C300   C     0.38217   0.68858  -0.51613   0.00000  Uiso   1.00
C301   C     0.37718   0.68250  -0.52149   0.00000  Uiso   1.00
C302   C     0.37644   0.67374  -0.51899   0.00000  Uiso   1.00
H303   H     0.36632   0.65918  -0.51392   0.00000  Uiso   1.00
H304   H     0.39298   0.66035  -0.50206   0.00000  Uiso   1.00
H305   H     0.38870   0.67447  -0.49951   0.00000  Uiso   1.00
H306   H     0.39018   0.68991  -0.50387   0.00000  Uiso   1.00
H307   H     0.37396   0.68472  -0.52769   0.00000  Uiso   1.00
H308   H     0.37264   0.66920  -0.52333   0.00000  Uiso   1.00
C309   C     0.40324   0.61033  -0.47738   0.00000  Uiso   1.00
C310   C     0.40425   0.61908  -0.48105   0.00000  Uiso   1.00
C311   C     0.39739   0.62334  -0.48530   0.00000  Uiso   1.00
C312   C     0.38896   0.61904  -0.48629   0.00000  Uiso   1.00
C313   C     0.38774   0.61042  -0.48247   0.00000  Uiso   1.00
C314   C     0.39460   0.60633  -0.47808   0.00000  Uiso   1.00
C315   C     0.38218   0.62300  -0.49115   0.00000  Uiso   1.00
N316   N     0.37460   0.61826  -0.49227   0.00000  Uiso   1.00
C317   C     0.36838   0.62230  -0.49737   0.00000  Uiso   1.00
N318   N     0.36916   0.63048  -0.50105   0.00000  Uiso   1.00
C319   C     0.37693   0.63468  -0.49928   0.00000  Uiso   1.00
N320   N     0.38373   0.63122  -0.49448   0.00000  Uiso   1.00
H321   H     0.39858   0.62998  -0.48819   0.00000  Uiso   1.00
H322   H     0.38132   0.60691  -0.48304   0.00000  Uiso   1.00
H323   H     0.41074   0.62250  -0.48081   0.00000  Uiso   1.00
H324   H     0.39332   0.59969  -0.47525   0.00000  Uiso   1.00
C325   C     0.34504   0.60772  -0.50348   0.00000  Uiso   1.00
C326   C     0.35152   0.60436  -0.49735   0.00000  Uiso   1.00
C327   C     0.35909   0.60903  -0.49529   0.00000  Uiso   1.00
C328   C     0.36059   0.61764  -0.49907   0.00000  Uiso   1.00
C329   C     0.35406   0.62126  -0.50494   0.00000  Uiso   1.00
C330   C     0.34666   0.61641  -0.50710   0.00000  Uiso   1.00
H331   H     0.36397   0.60604  -0.49071   0.00000  Uiso   1.00
H332   H     0.35500   0.62783  -0.50805   0.00000  Uiso   1.00
H333   H     0.35067   0.59778  -0.49425   0.00000  Uiso   1.00
H334   H     0.34208   0.61938  -0.51199   0.00000  Uiso   1.00
C335   C     0.40700   0.72691  -0.50116   0.00000  Uiso   1.00
C336   C     0.40274   0.73039  -0.50898   0.00000  Uiso   1.00
C337   C     0.39666   0.72547  -0.51370   0.00000  Uiso   1.00
C338   C     0.39448   0.71662  -0.51093   0.00000  Uiso   1.00
C339   C     0.39833   0.71323  -0.50292   0.00000  Uiso   1.00
C340   C     0.40427   0.71827  -0.49819   0.00000  Uiso   1.00
H341   H     0.39380   0.72828  -0.51985   0.00000  Uiso   1.00
H342   H     0.39675   0.70648  -0.50052   0.00000  Uiso   1.00
H343   H     0.40466   0.73697  -0.51159   0.00000  Uiso   1.00
H344   H     0.40719   0.71533  -0.49214   0.00000  Uiso   1.00
C345   C     0.38318   0.69742  -0.51867   0.00000  Uiso   1.00
N346   N     0.37924   0.70010  -0.52631   0.00000  Uiso   1.00
C347   C     0.38062   0.70876  -0.52841   0.00000  Uiso   1.00
N348   N     0.38558   0.71458  -0.52362   0.00000  Uiso   1.00
C349   C     0.38916   0.71114  -0.51611   0.00000  Uiso   1.00
N350   N     0.38814   0.70265  -0.51329   0.00000  Uiso   1.00
C351   C     0.36827   0.71848  -0.55179   0.00000  Uiso   1.00
C352   C     0.36740   0.70936  -0.54910   0.00000  Uiso   1.00
C353   C     0.37139   0.70616  -0.54155   0.00000  Uiso   1.00
C354   C     0.37666   0.71194  -0.53612   0.00000  Uiso   1.00
C355   C     0.37768   0.72104  -0.53871   0.00000  Uiso   1.00
C356   C     0.37360   0.72415  -0.54625   0.00000  Uiso   1.00
H357   H     0.37047   0.69912  -0.53977   0.00000  Uiso   1.00
H358   H     0.38166   0.72568  -0.53466   0.00000  Uiso   1.00
H359   H     0.36346   0.70468  -0.55315   0.00000  Uiso   1.00
H360   H     0.37440   0.73125  -0.54791   0.00000  Uiso   1.00
C361   C     0.65642   0.64605  -0.49855   0.00000  Uiso   1.00
C362   C     0.64748   0.64307  -0.49695   0.00000  Uiso   1.00
C363   C     0.64400   0.63588  -0.50133   0.00000  Uiso   1.00
C364   C     0.64923   0.63122  -0.50777   0.00000  Uiso   1.00
C365   C     0.65819   0.63400  -0.50937   0.00000  Uiso   1.00
C366   C     0.66168   0.64102  -0.50473   0.00000  Uiso   1.00
H367   H     0.63706   0.63392  -0.50000   0.00000  Uiso   1.00
H368   H     0.66242   0.63052  -0.51423   0.00000  Uiso   1.00
C369   C     0.65987   0.65402  -0.49445   0.00000  Uiso   1.00
C370   C     0.66919   0.65504  -0.49263   0.00000  Uiso   1.00
C371   C     0.67252   0.66264  -0.48886   0.00000  Uiso   1.00
C372   C     0.66667   0.66979  -0.48658   0.00000  Uiso   1.00
C373   C     0.65738   0.66898  -0.48847   0.00000  Uiso   1.00
C374   C     0.65413   0.66134  -0.49225   0.00000  Uiso   1.00
H375   H     0.64322   0.64663  -0.49216   0.00000  Uiso   1.00
H376   H     0.66858   0.64303  -0.50620   0.00000  Uiso   1.00
H377   H     0.67387   0.64960  -0.49417   0.00000  Uiso   1.00
H378   H     0.67971   0.66307  -0.48751   0.00000  Uiso   1.00
H379   H     0.65271   0.67440  -0.48683   0.00000  Uiso   1.00
H380   H     0.64695   0.66096  -0.49369   0.00000  Uiso   1.00
C381   C     0.66160   0.60252  -0.54472   0.00000  Uiso   1.00
C382   C     0.66508   0.60986  -0.53967   0.00000  Uiso   1.00
C383   C     0.66050   0.61335  -0.53259   0.00000  Uiso   1.00
C384   C     0.65201   0.60980  -0.53017   0.00000  Uiso   1.00
C385   C     0.64846   0.60246  -0.53505   0.00000  Uiso   1.00
C386   C     0.65314   0.59891  -0.54203   0.00000  Uiso   1.00
C387   C     0.64714   0.61362  -0.52331   0.00000  Uiso   1.00
N388   N     0.63902   0.61015  -0.52159   0.00000  Uiso   1.00
C389   C     0.63448   0.61426  -0.51498   0.00000  Uiso   1.00
N390   N     0.63743   0.62134  -0.51027   0.00000  Uiso   1.00
C391   C     0.64570   0.62412  -0.51248   0.00000  Uiso   1.00
N392   N     0.65088   0.62051  -0.51891   0.00000  Uiso   1.00
H393   H     0.66339   0.61903  -0.52895   0.00000  Uiso   1.00
H394   H     0.64192   0.59960  -0.53335   0.00000  Uiso   1.00
H395   H     0.67155   0.61280  -0.54150   0.00000  Uiso   1.00
H396   H     0.65017   0.59336  -0.54580   0.00000  Uiso   1.00
C397   C     0.61050   0.60216  -0.50681   0.00000  Uiso   1.00
C398   C     0.61536   0.59893  -0.51435   0.00000  Uiso   1.00
C399   C     0.62297   0.60304  -0.51725   0.00000  Uiso   1.00
C400   C     0.62624   0.61076  -0.51275   0.00000  Uiso   1.00
C401   C     0.62122   0.61440  -0.50554   0.00000  Uiso   1.00
C402   C     0.61362   0.61022  -0.50270   0.00000  Uiso   1.00
H403   H     0.62666   0.60010  -0.52287   0.00000  Uiso   1.00
H404   H     0.62355   0.62035  -0.50195   0.00000  Uiso   1.00
H405   H     0.61318   0.59284  -0.51781   0.00000  Uiso   1.00
H406   H     0.61018   0.61293  -0.49681   0.00000  Uiso   1.00
C407   C     0.70912   0.68725  -0.47115   0.00000  Uiso   1.00
C408   C     0.70298   0.69412  -0.46857   0.00000  Uiso   1.00
C409   C     0.69405   0.69342  -0.47028   0.00000  Uiso   1.00
C410   C     0.69061   0.68569  -0.47463   0.00000  Uiso   1.00
C411   C     0.69658   0.67869  -0.47709   0.00000  Uiso   1.00
C412   C     0.70551   0.67950  -0.47543   0.00000  Uiso   1.00
H413   H     0.68962   0.69892  -0.46831   0.00000  Uiso   1.00
H414   H     0.69412   0.67265  -0.48044   0.00000  Uiso   1.00
H415   H     0.70547   0.70024  -0.46537   0.00000  Uiso   1.00
H416   H     0.70998   0.67405  -0.47748   0.00000  Uiso   1.00
C417   C     0.66994   0.67733  -0.48239   0.00000  Uiso   1.00
N418   N     0.66404   0.68378  -0.48023   0.00000  Uiso   1.00
C419   C     0.66763   0.69092  -0.47609   0.00000  Uiso   1.00
N420   N     0.67635   0.69194  -0.47407   0.00000  Uiso   1.00
C421   C     0.68160   0.68504  -0.47653   0.00000  Uiso   1.00
N422   N     0.67879   0.67758  -0.48071   0.00000  Uiso   1.00
C423   C     0.65016   0.71174  -0.46871   0.00000  Uiso   1.00
C424   C     0.64696   0.70386  -0.47309   0.00000  Uiso   1.00
C425   C     0.65259   0.69712  -0.47554   0.00000  Uiso   1.00
C426   C     0.66190   0.69776  -0.47369   0.00000  Uiso   1.00
C427   C     0.66523   0.70553  -0.46931   0.00000  Uiso   1.00
C428   C     0.65954   0.71225  -0.46695   0.00000  Uiso   1.00
H429   H     0.64982   0.69123  -0.47891   0.00000  Uiso   1.00
H430   H     0.67237   0.70622  -0.46779   0.00000  Uiso   1.00
H431   H     0.63982   0.70321  -0.47470   0.00000  Uiso   1.00
H432   H     0.66231   0.71813  -0.46355   0.00000  Uiso   1.00
C433   C     0.59972   0.46463  -0.50013   0.00000  Uiso   1.00
C434   C     0.59986   0.45636  -0.49531   0.00000  Uiso   1.00
C435   C     0.60662   0.45036  -0.49637   0.00000  Uiso   1.00
C436   C     0.61372   0.45218  -0.50243   0.00000  Uiso   1.00
C437   C     0.61362   0.46029  -0.50743   0.00000  Uiso   1.00
C438   C     0.60688   0.46630  -0.50625   0.00000  Uiso   1.00
H439   H     0.60651   0.44418  -0.49242   0.00000  Uiso   1.00
H440   H     0.61901   0.46186  -0.51215   0.00000  Uiso   1.00
C441   C     0.59278   0.47106  -0.49865   0.00000  Uiso   1.00
C442   C     0.59463   0.48044  -0.49842   0.00000  Uiso   1.00
C443   C     0.58812   0.48652  -0.49649   0.00000  Uiso   1.00
C444   C     0.57921   0.48361  -0.49479   0.00000  Uiso   1.00
C445   C     0.57721   0.47431  -0.49510   0.00000  Uiso   1.00
C446   C     0.58378   0.46828  -0.49697   0.00000  Uiso   1.00
H447   H     0.59455   0.45486  -0.49047   0.00000  Uiso   1.00
H448   H     0.60698   0.47254  -0.51013   0.00000  Uiso   1.00
H449   H     0.60148   0.48284  -0.49956   0.00000  Uiso   1.00
H450   H     0.58986   0.49364  -0.49626   0.00000  Uiso   1.00
H451   H     0.57042   0.47187  -0.49383   0.00000  Uiso   1.00
H452   H     0.58206   0.46115  -0.49713   0.00000  Uiso   1.00
C453   C     0.65472   0.44700  -0.52788   0.00000  Uiso   1.00
C454   C     0.64732   0.45303  -0.52714   0.00000  Uiso   1.00
C455   C     0.64066   0.45166  -0.52106   0.00000  Uiso   1.00
C456   C     0.64088   0.44402  -0.51537   0.00000  Uiso   1.00
C457   C     0.64822   0.43800  -0.51595   0.00000  Uiso   1.00
C458   C     0.65495   0.43951  -0.52190   0.00000  Uiso   1.00
C459   C     0.63396   0.44232  -0.50951   0.00000  Uiso   1.00
N460   N     0.63446   0.43473  -0.50469   0.00000  Uiso   1.00
C461   C     0.62749   0.43330  -0.49917   0.00000  Uiso   1.00
N462   N     0.62045   0.43881  -0.49817   0.00000  Uiso   1.00
C463   C     0.62072   0.44623  -0.50327   0.00000  Uiso   1.00
N464   N     0.62726   0.44832  -0.50909   0.00000  Uiso   1.00
H465   H     0.63508   0.45641  -0.52077   0.00000  Uiso   1.00
H466   H     0.64857   0.43206  -0.51165   0.00000  Uiso   1.00
H467   H     0.64692   0.45884  -0.53161   0.00000  Uiso   1.00
H468   H     0.66044   0.43466  -0.52235   0.00000  Uiso   1.00
C469   C     0.62746   0.40923  -0.48457   0.00000  Uiso   1.00
C470   C     0.63464   0.41149  -0.49045   0.00000  Uiso   1.00
C471   C     0.63473   0.41932  -0.49511   0.00000  Uiso   1.00
C472   C     0.62756   0.42551  -0.49421   0.00000  Uiso   1.00
C473   C     0.62039   0.42344  -0.48831   0.00000  Uiso   1.00
C474   C     0.62038   0.41558  -0.48368   0.00000  Uiso   1.00
H475   H     0.64034   0.42070  -0.49963   0.00000  Uiso   1.00
H476   H     0.61476   0.42806  -0.48746   0.00000  Uiso   1.00
H477   H     0.64018   0.40679  -0.49151   0.00000  Uiso   1.00
H478   H     0.61474   0.41420  -0.47919   0.00000  Uiso   1.00
C479   C     0.57317   0.53164  -0.48899   0.00000  Uiso   1.00
C480   C     0.56436   0.52806  -0.48818   0.00000  Uiso   1.00
C481   C     0.56274   0.51914  -0.48875   0.00000  Uiso   1.00
C482   C     0.56987   0.51308  -0.49048   0.00000  Uiso   1.00
C483   C     0.57866   0.51652  -0.49171   0.00000  Uiso   1.00
C484   C     0.58021   0.52549  -0.49094   0.00000  Uiso   1.00
H485   H     0.55587   0.51674  -0.48788   0.00000  Uiso   1.00
H486   H     0.58428   0.51202  -0.49310   0.00000  Uiso   1.00
H487   H     0.55862   0.53246  -0.48694   0.00000  Uiso   1.00
H488   H     0.58711   0.52788  -0.49163   0.00000  Uiso   1.00
C489   C     0.57258   0.48971  -0.49282   0.00000  Uiso   1.00
N490   N     0.56435   0.48642  -0.49113   0.00000  Uiso   1.00
C491   C     0.55818   0.49266  -0.48921   0.00000  Uiso   1.00
N492   N     0.55967   0.50152  -0.48902   0.00000  Uiso   1.00
C493   C     0.56813   0.50402  -0.49077   0.00000  Uiso   1.00
N494   N     0.57490   0.49842  -0.49267   0.00000  Uiso   1.00
C495   C     0.53246   0.48456  -0.48119   0.00000  Uiso   1.00
C496   C     0.53896   0.47813  -0.48399   0.00000  Uiso   1.00
C497   C     0.54728   0.48067  -0.48681   0.00000  Uiso   1.00
C498   C     0.54962   0.48989  -0.48711   0.00000  Uiso   1.00
C499   C     0.54309   0.49639  -0.48476   0.00000  Uiso   1.00
C500   C     0.53486   0.49377  -0.48188   0.00000  Uiso   1.00
H501   H     0.55218   0.47552  -0.48861   0.00000  Uiso   1.00
H502   H     0.54462   0.50356  -0.48497   0.00000  Uiso   1.00
H503   H     0.53745   0.47096  -0.48353   0.00000  Uiso   1.00
H504   H     0.53007   0.49900  -0.48000   0.00000  Uiso   1.00
C505   C     0.61967   0.43930  -0.56935   0.00000  Uiso   1.00
C506   C     0.61159   0.43444  -0.56783   0.00000  Uiso   1.00
C507   C     0.60854   0.42826  -0.57379   0.00000  Uiso   1.00
C508   C     0.61347   0.42642  -0.58171   0.00000  Uiso   1.00
C509   C     0.62160   0.43110  -0.58331   0.00000  Uiso   1.00
C510   C     0.62455   0.43731  -0.57732   0.00000  Uiso   1.00
H511   H     0.60227   0.42474  -0.57235   0.00000  Uiso   1.00
H512   H     0.62554   0.42986  -0.58936   0.00000  Uiso   1.00
C513   C     0.62264   0.44612  -0.56325   0.00000  Uiso   1.00
C514   C     0.63188   0.44837  -0.56242   0.00000  Uiso   1.00
C515   C     0.63469   0.45518  -0.55704   0.00000  Uiso   1.00
C516   C     0.62837   0.46020  -0.55202   0.00000  Uiso   1.00
C517   C     0.61915   0.45796  -0.55259   0.00000  Uiso   1.00
C518   C     0.61643   0.45116  -0.55802   0.00000  Uiso   1.00
H519   H     0.60764   0.43565  -0.56177   0.00000  Uiso   1.00
H520   H     0.63073   0.44094  -0.57889   0.00000  Uiso   1.00
H521   H     0.63695   0.44466  -0.56621   0.00000  Uiso   1.00
H522   H     0.64184   0.45676  -0.55677   0.00000  Uiso   1.00
H523   H     0.61412   0.46171  -0.54881   0.00000  Uiso   1.00
H524   H     0.60924   0.44980  -0.55849   0.00000  Uiso   1.00
C525   C     0.62839   0.40613  -0.62281   0.00000  Uiso   1.00
C526   C     0.63087   0.41295  -0.61660   0.00000  Uiso   1.00
C527   C     0.62554   0.41516  -0.60956   0.00000  Uiso   1.00
C528   C     0.61726   0.41066  -0.60821   0.00000  Uiso   1.00
C529   C     0.61454   0.40399  -0.61444   0.00000  Uiso   1.00
C530   C     0.61995   0.40182  -0.62147   0.00000  Uiso   1.00
C531   C     0.61216   0.41256  -0.60077   0.00000  Uiso   1.00
N532   N     0.60442   0.40806  -0.59969   0.00000  Uiso   1.00
C533   C     0.59993   0.41014  -0.59216   0.00000  Uiso   1.00
N534   N     0.60262   0.41611  -0.58596   0.00000  Uiso   1.00
C535   C     0.61040   0.42021  -0.58780   0.00000  Uiso   1.00
N536   N     0.61544   0.41872  -0.59509   0.00000  Uiso   1.00
H537   H     0.62781   0.42036  -0.60491   0.00000  Uiso   1.00
H538   H     0.60822   0.40039  -0.61356   0.00000  Uiso   1.00
H539   H     0.63722   0.41654  -0.61741   0.00000  Uiso   1.00
H540   H     0.61780   0.39648  -0.62601   0.00000  Uiso   1.00
C541   C     0.57528   0.39742  -0.58730   0.00000  Uiso   1.00
C542   C     0.58036   0.39554  -0.59516   0.00000  Uiso   1.00
C543   C     0.58838   0.39958  -0.59679   0.00000  Uiso   1.00
C544   C     0.59192   0.40586  -0.59058   0.00000  Uiso   1.00
C545   C     0.58701   0.40774  -0.58265   0.00000  Uiso   1.00
C546   C     0.57904   0.40362  -0.58110   0.00000  Uiso   1.00
H547   H     0.59199   0.39799  -0.60297   0.00000  Uiso   1.00
H548   H     0.58955   0.41250  -0.57767   0.00000  Uiso   1.00
H549   H     0.57782   0.39086  -0.60020   0.00000  Uiso   1.00
H550   H     0.57559   0.40522  -0.57483   0.00000  Uiso   1.00
C551   C     0.66967   0.48244  -0.54125   0.00000  Uiso   1.00
C552   C     0.66340   0.48756  -0.53616   0.00000  Uiso   1.00
C553   C     0.65447   0.48562  -0.53622   0.00000  Uiso   1.00
C554   C     0.65122   0.47837  -0.54145   0.00000  Uiso   1.00
C555   C     0.65736   0.47322  -0.54657   0.00000  Uiso   1.00
C556   C     0.66625   0.47515  -0.54640   0.00000  Uiso   1.00
H557   H     0.64989   0.48971  -0.53221   0.00000  Uiso   1.00
H558   H     0.65504   0.46766  -0.55076   0.00000  Uiso   1.00
H559   H     0.66574   0.49320  -0.53210   0.00000  Uiso   1.00
C560   C     0.63114   0.46734  -0.54686   0.00000  Uiso   1.00
N561   N     0.62484   0.47192  -0.54241   0.00000  Uiso   1.00
C562   C     0.62790   0.47889  -0.53757   0.00000  Uiso   1.00
N563   N     0.63653   0.48140  -0.53691   0.00000  Uiso   1.00
C564   C     0.64223   0.47628  -0.54167   0.00000  Uiso   1.00
N565   N     0.63992   0.46921  -0.54676   0.00000  Uiso   1.00
C566   C     0.60804   0.49395  -0.52450   0.00000  Uiso   1.00
C567   C     0.60593   0.48622  -0.52971   0.00000  Uiso   1.00
C568   C     0.61238   0.48130  -0.53382   0.00000  Uiso   1.00
C569   C     0.62152   0.48382  -0.53307   0.00000  Uiso   1.00
C570   C     0.62380   0.49149  -0.52791   0.00000  Uiso   1.00
C571   C     0.61726   0.49639  -0.52382   0.00000  Uiso   1.00
H572   H     0.61034   0.47546  -0.53777   0.00000  Uiso   1.00
H573   H     0.63080   0.49360  -0.52725   0.00000  Uiso   1.00
H574   H     0.59894   0.48415  -0.53063   0.00000  Uiso   1.00
H575   H     0.61918   0.50228  -0.51989   0.00000  Uiso   1.00
H576   H     0.67078   0.47114  -0.55055   0.00000  Uiso   1.00
C577   C     0.45016   0.39967  -0.56363   0.00000  Uiso   1.00
C578   C     0.45715   0.39602  -0.56907   0.00000  Uiso   1.00
C579   C     0.46579   0.39878  -0.56815   0.00000  Uiso   1.00
C580   C     0.46798   0.40552  -0.56181   0.00000  Uiso   1.00
C581   C     0.46110   0.40937  -0.55647   0.00000  Uiso   1.00
C582   C     0.45250   0.40649  -0.55734   0.00000  Uiso   1.00
H583   H     0.47097   0.39572  -0.57234   0.00000  Uiso   1.00
H584   H     0.46261   0.41458  -0.55155   0.00000  Uiso   1.00
C585   C     0.44121   0.39644  -0.56427   0.00000  Uiso   1.00
C586   C     0.43598   0.39476  -0.55642   0.00000  Uiso   1.00
C587   C     0.42755   0.39136  -0.55699   0.00000  Uiso   1.00
C588   C     0.42370   0.38955  -0.56551   0.00000  Uiso   1.00
C589   C     0.42871   0.39136  -0.57339   0.00000  Uiso   1.00
C590   C     0.43721   0.39458  -0.57277   0.00000  Uiso   1.00
H591   H     0.45562   0.39073  -0.57392   0.00000  Uiso   1.00
H592   H     0.44730   0.40948  -0.55311   0.00000  Uiso   1.00
H593   H     0.43886   0.39602  -0.54979   0.00000  Uiso   1.00
H594   H     0.42383   0.39002  -0.55081   0.00000  Uiso   1.00
H595   H     0.42592   0.39001  -0.58003   0.00000  Uiso   1.00
H596   H     0.44101   0.39582  -0.57893   0.00000  Uiso   1.00
C597   C     0.49235   0.43700  -0.53472   0.00000  Uiso   1.00
C598   C     0.48342   0.43430  -0.53673   0.00000  Uiso   1.00
C599   C     0.48164   0.42778  -0.54283   0.00000  Uiso   1.00
C600   C     0.48874   0.42359  -0.54756   0.00000  Uiso   1.00
C601   C     0.49770   0.42621  -0.54574   0.00000  Uiso   1.00
C602   C     0.49938   0.43257  -0.53943   0.00000  Uiso   1.00
C603   C     0.48688   0.41704  -0.55377   0.00000  Uiso   1.00
N604   N     0.49375   0.41352  -0.55840   0.00000  Uiso   1.00
C605   C     0.49137   0.40722  -0.56438   0.00000  Uiso   1.00
N606   N     0.48298   0.40428  -0.56582   0.00000  Uiso   1.00
C607   C     0.47671   0.40825  -0.56074   0.00000  Uiso   1.00
N608   N     0.47825   0.41469  -0.55467   0.00000  Uiso   1.00
H609   H     0.47466   0.42594  -0.54409   0.00000  Uiso   1.00
H610   H     0.50332   0.42305  -0.54922   0.00000  Uiso   1.00
H611   H     0.47768   0.43748  -0.53346   0.00000  Uiso   1.00
H612   H     0.50640   0.43422  -0.53809   0.00000  Uiso   1.00
C613   C     0.51163   0.39628  -0.58056   0.00000  Uiso   1.00
C614   C     0.51356   0.40287  -0.57393   0.00000  Uiso   1.00
C615   C     0.50706   0.40635  -0.56857   0.00000  Uiso   1.00
C616   C     0.49806   0.40347  -0.56951   0.00000  Uiso   1.00
C617   C     0.49598   0.39683  -0.57599   0.00000  Uiso   1.00
C618   C     0.50256   0.39340  -0.58129   0.00000  Uiso   1.00
H619   H     0.50888   0.41146  -0.56363   0.00000  Uiso   1.00
H620   H     0.48910   0.39447  -0.57692   0.00000  Uiso   1.00
H621   H     0.52040   0.40531  -0.57297   0.00000  Uiso   1.00
H622   H     0.50060   0.38846  -0.58635   0.00000  Uiso   1.00
C623   C     0.39018   0.37104  -0.53613   0.00000  Uiso   1.00
C624   C     0.38613   0.37001  -0.54471   0.00000  Uiso   1.00
C625   C     0.39005   0.37321  -0.55230   0.00000  Uiso   1.00
C626   C     0.39846   0.37763  -0.55181   0.00000  Uiso   1.00
C627   C     0.40250   0.37896  -0.54331   0.00000  Uiso   1.00
C628   C     0.39847   0.37578  -0.53577   0.00000  Uiso   1.00
H629   H     0.38676   0.37207  -0.55875   0.00000  Uiso   1.00
H630   H     0.40900   0.38229  -0.54269   0.00000  Uiso   1.00
H631   H     0.37975   0.36646  -0.54538   0.00000  Uiso   1.00
H632   H     0.40199   0.37663  -0.52939   0.00000  Uiso   1.00
C633   C     0.41527   0.38586  -0.56612   0.00000  Uiso   1.00
N634   N     0.41202   0.38441  -0.57437   0.00000  Uiso   1.00
C635   C     0.40381   0.38073  -0.57459   0.00000  Uiso   1.00
N636   N     0.39893   0.37842  -0.56739   0.00000  Uiso   1.00
C637   C     0.40292   0.38012  -0.55949   0.00000  Uiso   1.00
N638   N     0.41102   0.38389  -0.55845   0.00000  Uiso   1.00
C639   C     0.39230   0.37760  -0.60003   0.00000  Uiso   1.00
C640   C     0.40124   0.38076  -0.59897   0.00000  Uiso   1.00
C641   C     0.40504   0.38166  -0.59074   0.00000  Uiso   1.00
C642   C     0.40017   0.37924  -0.58294   0.00000  Uiso   1.00
C643   C     0.39144   0.37558  -0.58387   0.00000  Uiso   1.00
C644   C     0.38768   0.37478  -0.59215   0.00000  Uiso   1.00
H645   H     0.41182   0.38442  -0.59027   0.00000  Uiso   1.00
H646   H     0.38755   0.37361  -0.57798   0.00000  Uiso   1.00
H647   H     0.40514   0.38288  -0.60481   0.00000  Uiso   1.00
H648   H     0.38076   0.37238  -0.59258   0.00000  Uiso   1.00
C649   C     0.38622   0.40400  -0.58284   0.00000  Uiso   1.00
C650   C     0.38932   0.40172  -0.59159   0.00000  Uiso   1.00
C651   C     0.39430   0.40750  -0.59657   0.00000  Uiso   1.00
C652   C     0.39637   0.41615  -0.59318   0.00000  Uiso   1.00
C653   C     0.39324   0.41862  -0.58453   0.00000  Uiso   1.00
C654   C     0.38841   0.41270  -0.57955   0.00000  Uiso   1.00
H655   H     0.39659   0.40540  -0.60321   0.00000  Uiso   1.00
H656   H     0.39470   0.42524  -0.58175   0.00000  Uiso   1.00
C657   C     0.38111   0.39780  -0.57759   0.00000  Uiso   1.00
C658   C     0.38188   0.39753  -0.56806   0.00000  Uiso   1.00
C659   C     0.37700   0.39170  -0.56304   0.00000  Uiso   1.00
C660   C     0.37096   0.38566  -0.56725   0.00000  Uiso   1.00
C661   C     0.37014   0.38578  -0.57673   0.00000  Uiso   1.00
C662   C     0.37502   0.39167  -0.58167   0.00000  Uiso   1.00
H663   H     0.38781   0.39512  -0.59440   0.00000  Uiso   1.00
H664   H     0.38607   0.41480  -0.57292   0.00000  Uiso   1.00
H665   H     0.38655   0.40204  -0.56463   0.00000  Uiso   1.00
H666   H     0.37780   0.39176  -0.55575   0.00000  Uiso   1.00
H667   H     0.36554   0.38122  -0.58017   0.00000  Uiso   1.00
H668   H     0.37413   0.39169  -0.58896   0.00000  Uiso   1.00
C669   C     0.41258   0.46172  -0.59027   0.00000  Uiso   1.00
C670   C     0.40756   0.45538  -0.58519   0.00000  Uiso   1.00
C671   C     0.40600   0.44694  -0.58825   0.00000  Uiso   1.00
C672   C     0.40938   0.44423  -0.59672   0.00000  Uiso   1.00
C673   C     0.41442   0.45044  -0.60189   0.00000  Uiso   1.00
C674   C     0.41592   0.45887  -0.59876   0.00000  Uiso   1.00
C675   C     0.40771   0.43573  -0.59992   0.00000  Uiso   1.00
N676   N     0.41104   0.43363  -0.60801   0.00000  Uiso   1.00
C677   C     0.40912   0.42529  -0.61083   0.00000  Uiso   1.00
N678   N     0.40426   0.41924  -0.60625   0.00000  Uiso   1.00
C679   C     0.40133   0.42208  -0.59822   0.00000  Uiso   1.00
N680   N     0.40286   0.43023  -0.59470   0.00000  Uiso   1.00
H681   H     0.40207   0.44233  -0.58412   0.00000  Uiso   1.00
H682   H     0.41713   0.44855  -0.60844   0.00000  Uiso   1.00
H683   H     0.40474   0.45728  -0.57868   0.00000  Uiso   1.00
H684   H     0.41988   0.46347  -0.60288   0.00000  Uiso   1.00
C685   C     0.42040   0.41707  -0.63525   0.00000  Uiso   1.00
C686   C     0.42164   0.42595  -0.63193   0.00000  Uiso   1.00
C687   C     0.41787   0.42870  -0.62410   0.00000  Uiso   1.00
C688   C     0.41248   0.42272  -0.61903   0.00000  Uiso   1.00
C689   C     0.41088   0.41395  -0.62239   0.00000  Uiso   1.00
C690   C     0.41471   0.41129  -0.63023   0.00000  Uiso   1.00
H691   H     0.41922   0.43550  -0.62170   0.00000  Uiso   1.00
H692   H     0.40673   0.40919  -0.61866   0.00000  Uiso   1.00
H693   H     0.42606   0.43063  -0.63546   0.00000  Uiso   1.00
H694   H     0.41348   0.40443  -0.63253   0.00000  Uiso   1.00
C695   C     0.36324   0.37529  -0.52062   0.00000  Uiso   1.00
C696   C     0.35752   0.36906  -0.52505   0.00000  Uiso   1.00
C697   C     0.35697   0.36870  -0.53415   0.00000  Uiso   1.00
C698   C     0.36219   0.37459  -0.53949   0.00000  Uiso   1.00
C699   C     0.36802   0.38076  -0.53521   0.00000  Uiso   1.00
C700   C     0.36852   0.38102  -0.52613   0.00000  Uiso   1.00
H701   H     0.35242   0.36386  -0.53725   0.00000  Uiso   1.00
H702   H     0.37217   0.38538  -0.53912   0.00000  Uiso   1.00
H703   H     0.35324   0.36455  -0.52115   0.00000  Uiso   1.00
H704   H     0.37316   0.38584  -0.52311   0.00000  Uiso   1.00
C705   C     0.36589   0.37982  -0.56220   0.00000  Uiso   1.00
N706   N     0.36040   0.37424  -0.56664   0.00000  Uiso   1.00
C707   C     0.35558   0.36872  -0.56139   0.00000  Uiso   1.00
N708   N     0.35590   0.36850  -0.55240   0.00000  Uiso   1.00
C709   C     0.36160   0.37441  -0.54871   0.00000  Uiso   1.00
N710   N     0.36678   0.38021  -0.55325   0.00000  Uiso   1.00
C711   C     0.33830   0.35074  -0.57443   0.00000  Uiso   1.00
C712   C     0.34371   0.35692  -0.57933   0.00000  Uiso   1.00
C713   C     0.34929   0.36276  -0.57513   0.00000  Uiso   1.00
C714   C     0.34987   0.36285  -0.56563   0.00000  Uiso   1.00
C715   C     0.34451   0.35679  -0.56061   0.00000  Uiso   1.00
C716   C     0.33892   0.35098  -0.56490   0.00000  Uiso   1.00
H717   H     0.35331   0.36736  -0.57919   0.00000  Uiso   1.00
H718   H     0.34480   0.35670  -0.55329   0.00000  Uiso   1.00
H719   H     0.34339   0.35710  -0.58666   0.00000  Uiso   1.00
H720   H     0.33496   0.34633  -0.56084   0.00000  Uiso   1.00
C721   C     0.31260   0.33705  -0.39512   0.00000  Uiso   1.00
C722   C     0.31462   0.32772  -0.39557   0.00000  Uiso   1.00
C723   C     0.31996   0.32430  -0.40210   0.00000  Uiso   1.00
C724   C     0.32370   0.33002  -0.40872   0.00000  Uiso   1.00
C725   C     0.32174   0.33933  -0.40843   0.00000  Uiso   1.00
C726   C     0.31640   0.34268  -0.40185   0.00000  Uiso   1.00
H727   H     0.32136   0.31710  -0.40213   0.00000  Uiso   1.00
H728   H     0.32451   0.34392  -0.41343   0.00000  Uiso   1.00
C729   C     0.30704   0.34064  -0.38815   0.00000  Uiso   1.00
C730   C     0.30842   0.34945  -0.38473   0.00000  Uiso   1.00
C731   C     0.30322   0.35286  -0.37807   0.00000  Uiso   1.00
C732   C     0.29616   0.34764  -0.37437   0.00000  Uiso   1.00
C733   C     0.29466   0.33886  -0.37770   0.00000  Uiso   1.00
C734   C     0.29993   0.33551  -0.38434   0.00000  Uiso   1.00
H735   H     0.31195   0.32314  -0.39049   0.00000  Uiso   1.00
H736   H     0.31498   0.34988  -0.40184   0.00000  Uiso   1.00
H737   H     0.31386   0.35361  -0.38737   0.00000  Uiso   1.00
H738   H     0.30456   0.35965  -0.37565   0.00000  Uiso   1.00
H739   H     0.28927   0.33468  -0.37499   0.00000  Uiso   1.00
H740   H     0.29854   0.32874  -0.38681   0.00000  Uiso   1.00
C741   C     0.34984   0.34632  -0.44589   0.00000  Uiso   1.00
C742   C     0.34378   0.34942  -0.43915   0.00000  Uiso   1.00
C743   C     0.33980   0.34368  -0.43333   0.00000  Uiso   1.00
C744   C     0.34164   0.33435  -0.43377   0.00000  Uiso   1.00
C745   C     0.34748   0.33108  -0.44055   0.00000  Uiso   1.00
C746   C     0.35139   0.33688  -0.44643   0.00000  Uiso   1.00
C747   C     0.33794   0.32865  -0.42752   0.00000  Uiso   1.00
N748   N     0.34004   0.31991  -0.42803   0.00000  Uiso   1.00
C749   C     0.33629   0.31479  -0.42163   0.00000  Uiso   1.00
N750   N     0.33083   0.31775  -0.41511   0.00000  Uiso   1.00
C751   C     0.32920   0.32660  -0.41529   0.00000  Uiso   1.00
N752   N     0.33258   0.33237  -0.42131   0.00000  Uiso   1.00
H753   H     0.33529   0.34640  -0.42821   0.00000  Uiso   1.00
H754   H     0.34900   0.32393  -0.44106   0.00000  Uiso   1.00
H755   H     0.34228   0.35658  -0.43861   0.00000  Uiso   1.00
H756   H     0.35600   0.33424  -0.45150   0.00000  Uiso   1.00
C757   C     0.34234   0.28732  -0.42143   0.00000  Uiso   1.00
C758   C     0.34596   0.29314  -0.42809   0.00000  Uiso   1.00
C759   C     0.34401   0.30205  -0.42823   0.00000  Uiso   1.00
C760   C     0.33823   0.30577  -0.42165   0.00000  Uiso   1.00
C761   C     0.33451   0.30008  -0.41499   0.00000  Uiso   1.00
C762   C     0.33654   0.29120  -0.41489   0.00000  Uiso   1.00
H763   H     0.34698   0.30627  -0.43343   0.00000  Uiso   1.00
H764   H     0.33002   0.30273  -0.40983   0.00000  Uiso   1.00
H765   H     0.35050   0.29048  -0.43320   0.00000  Uiso   1.00
H766   H     0.33348   0.28698  -0.40973   0.00000  Uiso   1.00
C767   C     0.29160   0.38868  -0.34902   0.00000  Uiso   1.00
C768   C     0.28471   0.38318  -0.34535   0.00000  Uiso   1.00
C769   C     0.28333   0.37464  -0.34825   0.00000  Uiso   1.00
C770   C     0.28882   0.37098  -0.35511   0.00000  Uiso   1.00
C771   C     0.29580   0.37630  -0.35878   0.00000  Uiso   1.00
C772   C     0.29712   0.38482  -0.35581   0.00000  Uiso   1.00
H773   H     0.27791   0.37071  -0.34527   0.00000  Uiso   1.00
H774   H     0.30015   0.37368  -0.36407   0.00000  Uiso   1.00
H775   H     0.28036   0.38578  -0.34005   0.00000  Uiso   1.00
H776   H     0.30244   0.38880  -0.35892   0.00000  Uiso   1.00
C777   C     0.29086   0.35108  -0.36765   0.00000  Uiso   1.00
N778   N     0.28427   0.34582  -0.36447   0.00000  Uiso   1.00
C779   C     0.27931   0.34954  -0.35794   0.00000  Uiso   1.00
N780   N     0.28050   0.35781  -0.35457   0.00000  Uiso   1.00
C781   C     0.28729   0.36244  -0.35827   0.00000  Uiso   1.00
N782   N     0.29268   0.35943  -0.36482   0.00000  Uiso   1.00
C783   C     0.25822   0.33422  -0.34731   0.00000  Uiso   1.00
C784   C     0.26390   0.33077  -0.35418   0.00000  Uiso   1.00
C785   C     0.27074   0.33570  -0.35765   0.00000  Uiso   1.00
C786   C     0.27242   0.34449  -0.35443   0.00000  Uiso   1.00
C787   C     0.26689   0.34802  -0.34754   0.00000  Uiso   1.00
C788   C     0.26005   0.34304  -0.34414   0.00000  Uiso   1.00
H789   H     0.27487   0.33278  -0.36297   0.00000  Uiso   1.00
H790   H     0.26802   0.35477  -0.34489   0.00000  Uiso   1.00
H791   H     0.26270   0.32406  -0.35690   0.00000  Uiso   1.00
H792   H     0.25596   0.34596  -0.33879   0.00000  Uiso   1.00
C793   C     0.33624   0.51416  -0.36079   0.00000  Uiso   1.00
C794   C     0.32715   0.51122  -0.36054   0.00000  Uiso   1.00
C795   C     0.32428   0.50420  -0.36559   0.00000  Uiso   1.00
C796   C     0.33034   0.49963  -0.37133   0.00000  Uiso   1.00
C797   C     0.33945   0.50236  -0.37159   0.00000  Uiso   1.00
C798   C     0.34226   0.50938  -0.36648   0.00000  Uiso   1.00
H799   H     0.31722   0.50225  -0.36523   0.00000  Uiso   1.00
H800   H     0.34426   0.49898  -0.37597   0.00000  Uiso   1.00
C801   C     0.33912   0.52170  -0.35561   0.00000  Uiso   1.00
C802   C     0.34776   0.52195  -0.35151   0.00000  Uiso   1.00
C803   C     0.35041   0.52901  -0.34639   0.00000  Uiso   1.00
C804   C     0.34458   0.53644  -0.34510   0.00000  Uiso   1.00
C805   C     0.33601   0.53638  -0.34923   0.00000  Uiso   1.00
C806   C     0.33340   0.52924  -0.35425   0.00000  Uiso   1.00
H807   H     0.32231   0.51463  -0.35620   0.00000  Uiso   1.00
H808   H     0.34928   0.51147  -0.36695   0.00000  Uiso   1.00
H809   H     0.35235   0.51628  -0.35231   0.00000  Uiso   1.00
H810   H     0.35706   0.52886  -0.34329   0.00000  Uiso   1.00
H811   H     0.33138   0.54199  -0.34838   0.00000  Uiso   1.00
H812   H     0.32674   0.52938  -0.35735   0.00000  Uiso   1.00
C813   C     0.34670   0.47060  -0.40654   0.00000  Uiso   1.00
C814   C     0.34994   0.47708  -0.40031   0.00000  Uiso   1.00
C815   C     0.34452   0.48075  -0.39396   0.00000  Uiso   1.00
C816   C     0.33538   0.47815  -0.39339   0.00000  Uiso   1.00
C817   C     0.33210   0.47147  -0.39933   0.00000  Uiso   1.00
C818   C     0.33758   0.46784  -0.40565   0.00000  Uiso   1.00
C819   C     0.32971   0.48234  -0.38745   0.00000  Uiso   1.00
N820   N     0.32108   0.47974  -0.38747   0.00000  Uiso   1.00
C821   C     0.31582   0.48420  -0.38169   0.00000  Uiso   1.00
N822   N     0.31853   0.49077  -0.37617   0.00000  Uiso   1.00
C823   C     0.32728   0.49280  -0.37674   0.00000  Uiso   1.00
N824   N     0.33320   0.48882  -0.38224   0.00000  Uiso   1.00
H825   H     0.34727   0.48586  -0.38947   0.00000  Uiso   1.00
H826   H     0.32509   0.46932  -0.39906   0.00000  Uiso   1.00
H827   H     0.35690   0.47934  -0.40065   0.00000  Uiso   1.00
H828   H     0.33474   0.46296  -0.41033   0.00000  Uiso   1.00
C829   C     0.28836   0.47813  -0.38159   0.00000  Uiso   1.00
C830   C     0.29445   0.47344  -0.38727   0.00000  Uiso   1.00
C831   C     0.30338   0.47527  -0.38725   0.00000  Uiso   1.00
C832   C     0.30686   0.48198  -0.38147   0.00000  Uiso   1.00
C833   C     0.30094   0.48662  -0.37564   0.00000  Uiso   1.00
C834   C     0.29202   0.48474  -0.37574   0.00000  Uiso   1.00
H835   H     0.30778   0.47160  -0.39183   0.00000  Uiso   1.00
H836   H     0.30341   0.49182  -0.37110   0.00000  Uiso   1.00
H837   H     0.29194   0.46838  -0.39196   0.00000  Uiso   1.00
H838   H     0.28763   0.48846  -0.37119   0.00000  Uiso   1.00
C839   C     0.38223   0.54997  -0.31758   0.00000  Uiso   1.00
C840   C     0.37604   0.55714  -0.31645   0.00000  Uiso   1.00
C841   C     0.36806   0.55736  -0.32085   0.00000  Uiso   1.00
C842   C     0.36559   0.55025  -0.32666   0.00000  Uiso   1.00
C843   C     0.37167   0.54304  -0.32793   0.00000  Uiso   1.00
C844   C     0.37970   0.54302  -0.32361   0.00000  Uiso   1.00
H845   H     0.36353   0.56301  -0.31969   0.00000  Uiso   1.00
H846   H     0.37002   0.53747  -0.33240   0.00000  Uiso   1.00
H847   H     0.37750   0.56265  -0.31183   0.00000  Uiso   1.00
H848   H     0.38422   0.53738  -0.32491   0.00000  Uiso   1.00
C849   C     0.34717   0.54358  -0.33986   0.00000  Uiso   1.00
N850   N     0.34134   0.55040  -0.33903   0.00000  Uiso   1.00
C851   C     0.34421   0.55720  -0.33387   0.00000  Uiso   1.00
N852   N     0.35213   0.55750  -0.32959   0.00000  Uiso   1.00
C853   C     0.35739   0.55030  -0.33091   0.00000  Uiso   1.00
N854   N     0.35531   0.54318  -0.33601   0.00000  Uiso   1.00
C855   C     0.32814   0.58028  -0.33287   0.00000  Uiso   1.00
C856   C     0.32524   0.57239  -0.33739   0.00000  Uiso   1.00
C857   C     0.33029   0.56480  -0.33755   0.00000  Uiso   1.00
C858   C     0.33866   0.56454  -0.33304   0.00000  Uiso   1.00
C859   C     0.34148   0.57217  -0.32811   0.00000  Uiso   1.00
C860   C     0.33638   0.57974  -0.32807   0.00000  Uiso   1.00
H861   H     0.32789   0.55902  -0.34137   0.00000  Uiso   1.00
H862   H     0.34790   0.57220  -0.32456   0.00000  Uiso   1.00
H863   H     0.31891   0.57238  -0.34110   0.00000  Uiso   1.00
H864   H     0.33902   0.58563  -0.32457   0.00000  Uiso   1.00
C865   C     0.58258   0.68982  -0.39478   0.00000  Uiso   1.00
C866   C     0.58347   0.68464  -0.38679   0.00000  Uiso   1.00
C867   C     0.59128   0.68441  -0.38209   0.00000  Uiso   1.00
C868   C     0.59884   0.68933  -0.38514   0.00000  Uiso   1.00
C869   C     0.59808   0.69456  -0.39307   0.00000  Uiso   1.00
C870   C     0.59021   0.69483  -0.39765   0.00000  Uiso   1.00
H871   H     0.59165   0.68033  -0.37601   0.00000  Uiso   1.00
H872   H     0.60379   0.69841  -0.39559   0.00000  Uiso   1.00
C873   C     0.57445   0.68979  -0.39983   0.00000  Uiso   1.00
C874   C     0.57118   0.69770  -0.40413   0.00000  Uiso   1.00
C875   C     0.56344   0.69764  -0.40895   0.00000  Uiso   1.00
C876   C     0.55845   0.68959  -0.40988   0.00000  Uiso   1.00
C877   C     0.56164   0.68164  -0.40572   0.00000  Uiso   1.00
C878   C     0.56931   0.68178  -0.40082   0.00000  Uiso   1.00
H879   H     0.57776   0.68074  -0.38431   0.00000  Uiso   1.00
H880   H     0.58985   0.69881  -0.40381   0.00000  Uiso   1.00
H881   H     0.57489   0.70400  -0.40348   0.00000  Uiso   1.00
H882   H     0.56114   0.70387  -0.41207   0.00000  Uiso   1.00
H883   H     0.55795   0.67533  -0.40632   0.00000  Uiso   1.00
H884   H     0.57162   0.67555  -0.39771   0.00000  Uiso   1.00
C885   C     0.64402   0.70622  -0.38942   0.00000  Uiso   1.00
C886   C     0.63552   0.70680  -0.39377   0.00000  Uiso   1.00
C887   C     0.62813   0.70263  -0.39041   0.00000  Uiso   1.00
C888   C     0.62874   0.69757  -0.38238   0.00000  Uiso   1.00
C889   C     0.63709   0.69706  -0.37785   0.00000  Uiso   1.00
C890   C     0.64443   0.70123  -0.38129   0.00000  Uiso   1.00
C891   C     0.62137   0.69302  -0.37917   0.00000  Uiso   1.00
N892   N     0.62244   0.68821  -0.37163   0.00000  Uiso   1.00
C893   C     0.61507   0.68380  -0.36890   0.00000  Uiso   1.00
N894   N     0.60709   0.68390  -0.37307   0.00000  Uiso   1.00
C895   C     0.60682   0.68896  -0.38053   0.00000  Uiso   1.00
N896   N     0.61373   0.69366  -0.38389   0.00000  Uiso   1.00
H897   H     0.62180   0.70314  -0.39408   0.00000  Uiso   1.00
H898   H     0.63777   0.69322  -0.37163   0.00000  Uiso   1.00
H899   H     0.63486   0.71044  -0.40011   0.00000  Uiso   1.00
H900   H     0.65078   0.70064  -0.37766   0.00000  Uiso   1.00
C901   C     0.61750   0.66806  -0.34568   0.00000  Uiso   1.00
C902   C     0.62484   0.67318  -0.34903   0.00000  Uiso   1.00
C903   C     0.62408   0.67830  -0.35653   0.00000  Uiso   1.00
C904   C     0.61581   0.67870  -0.36123   0.00000  Uiso   1.00
C905   C     0.60838   0.67373  -0.35796   0.00000  Uiso   1.00
C906   C     0.60924   0.66859  -0.35047   0.00000  Uiso   1.00
H907   H     0.62993   0.68204  -0.35889   0.00000  Uiso   1.00
H908   H     0.60192   0.67391  -0.36142   0.00000  Uiso   1.00
H909   H     0.63135   0.67291  -0.34565   0.00000  Uiso   1.00
H910   H     0.60339   0.66484  -0.34811   0.00000  Uiso   1.00
C911   C     0.52925   0.72004  -0.43392   0.00000  Uiso   1.00
C912   C     0.52474   0.71167  -0.43473   0.00000  Uiso   1.00
C913   C     0.52825   0.70400  -0.43129   0.00000  Uiso   1.00
C914   C     0.53658   0.70420  -0.42668   0.00000  Uiso   1.00
C915   C     0.54125   0.71245  -0.42590   0.00000  Uiso   1.00
C916   C     0.53770   0.72006  -0.42945   0.00000  Uiso   1.00
H917   H     0.52448   0.69775  -0.43199   0.00000  Uiso   1.00
H918   H     0.54767   0.71282  -0.42238   0.00000  Uiso   1.00
H919   H     0.51824   0.71131  -0.43810   0.00000  Uiso   1.00
H920   H     0.54135   0.72635  -0.42849   0.00000  Uiso   1.00
C921   C     0.55057   0.68944  -0.41468   0.00000  Uiso   1.00
N922   N     0.54633   0.68152  -0.41529   0.00000  Uiso   1.00
C923   C     0.53864   0.68171  -0.41995   0.00000  Uiso   1.00
N924   N     0.53508   0.68901  -0.42382   0.00000  Uiso   1.00
C925   C     0.53994   0.69653  -0.42282   0.00000  Uiso   1.00
N926   N     0.54773   0.69716  -0.41835   0.00000  Uiso   1.00
C927   C     0.52632   0.65708  -0.42519   0.00000  Uiso   1.00
C928   C     0.53408   0.65765  -0.41963   0.00000  Uiso   1.00
C929   C     0.53788   0.66568  -0.41757   0.00000  Uiso   1.00
C930   C     0.53413   0.67373  -0.42098   0.00000  Uiso   1.00
C931   C     0.52607   0.67337  -0.42603   0.00000  Uiso   1.00
C932   C     0.52224   0.66532  -0.42794   0.00000  Uiso   1.00
H933   H     0.54408   0.66576  -0.41365   0.00000  Uiso   1.00
H934   H     0.52303   0.67948  -0.42871   0.00000  Uiso   1.00
H935   H     0.53742   0.65149  -0.41743   0.00000  Uiso   1.00
H936   H     0.51639   0.66515  -0.43236   0.00000  Uiso   1.00
C937   C     0.30827   0.53664  -0.51457   0.00000  Uiso   1.00
C938   C     0.29964   0.53276  -0.51321   0.00000  Uiso   1.00
C939   C     0.29870   0.52410  -0.51056   0.00000  Uiso   1.00
C940   C     0.30637   0.51862  -0.50923   0.00000  Uiso   1.00
C941   C     0.31502   0.52229  -0.51072   0.00000  Uiso   1.00
C942   C     0.31590   0.53100  -0.51326   0.00000  Uiso   1.00
H943   H     0.29194   0.52149  -0.50947   0.00000  Uiso   1.00
H944   H     0.32104   0.51822  -0.50975   0.00000  Uiso   1.00
C945   C     0.30920   0.54592  -0.51674   0.00000  Uiso   1.00
C946   C     0.31614   0.55123  -0.51284   0.00000  Uiso   1.00
C947   C     0.31662   0.56022  -0.51428   0.00000  Uiso   1.00
C948   C     0.31023   0.56452  -0.51989   0.00000  Uiso   1.00
C949   C     0.30342   0.55932  -0.52403   0.00000  Uiso   1.00
C950   C     0.30293   0.55035  -0.52245   0.00000  Uiso   1.00
H951   H     0.29360   0.53687  -0.51401   0.00000  Uiso   1.00
H952   H     0.32264   0.53372  -0.51427   0.00000  Uiso   1.00
H953   H     0.32100   0.54813  -0.50831   0.00000  Uiso   1.00
H954   H     0.32194   0.56405  -0.51100   0.00000  Uiso   1.00
H955   H     0.29844   0.56244  -0.52841   0.00000  Uiso   1.00
H956   H     0.29751   0.54652  -0.52559   0.00000  Uiso   1.00
C957   C     0.33263   0.47848  -0.50125   0.00000  Uiso   1.00
C958   C     0.33400   0.48785  -0.50302   0.00000  Uiso   1.00
C959   C     0.32699   0.49369  -0.50331   0.00000  Uiso   1.00
C960   C     0.31812   0.49064  -0.50162   0.00000  Uiso   1.00
C961   C     0.31670   0.48150  -0.49935   0.00000  Uiso   1.00
C962   C     0.32368   0.47564  -0.49924   0.00000  Uiso   1.00
C963   C     0.31092   0.49634  -0.50261   0.00000  Uiso   1.00
N964   N     0.30272   0.49292  -0.50094   0.00000  Uiso   1.00
C965   C     0.29594   0.49869  -0.50223   0.00000  Uiso   1.00
N966   N     0.29684   0.50719  -0.50504   0.00000  Uiso   1.00
C967   C     0.30530   0.50989  -0.50643   0.00000  Uiso   1.00
N968   N     0.31263   0.50478  -0.50530   0.00000  Uiso   1.00
H969   H     0.32828   0.50070  -0.50505   0.00000  Uiso   1.00
H970   H     0.30995   0.47896  -0.49800   0.00000  Uiso   1.00
H971   H     0.34074   0.49024  -0.50468   0.00000  Uiso   1.00
H972   H     0.32238   0.46854  -0.49789   0.00000  Uiso   1.00
C973   C     0.26965   0.49062  -0.49634   0.00000  Uiso   1.00
C974   C     0.27702   0.48466  -0.49507   0.00000  Uiso   1.00
C975   C     0.28556   0.48711  -0.49717   0.00000  Uiso   1.00
C976   C     0.28732   0.49583  -0.50055   0.00000  Uiso   1.00
C977   C     0.28006   0.50182  -0.50193   0.00000  Uiso   1.00
C978   C     0.27156   0.49926  -0.49995   0.00000  Uiso   1.00
H979   H     0.29104   0.48236  -0.49603   0.00000  Uiso   1.00
H980   H     0.28118   0.50860  -0.50451   0.00000  Uiso   1.00
H981   H     0.27585   0.47796  -0.49232   0.00000  Uiso   1.00
H982   H     0.26614   0.50413  -0.50091   0.00000  Uiso   1.00
C983   C     0.33744   0.60244  -0.50636   0.00000  Uiso   1.00
C984   C     0.33012   0.60645  -0.51095   0.00000  Uiso   1.00
C985   C     0.32354   0.60148  -0.51480   0.00000  Uiso   1.00
C986   C     0.32356   0.59202  -0.51392   0.00000  Uiso   1.00
C987   C     0.33051   0.58788  -0.50893   0.00000  Uiso   1.00
C988   C     0.33722   0.59295  -0.50537   0.00000  Uiso   1.00
H989   H     0.31824   0.60492  -0.51853   0.00000  Uiso   1.00
H990   H     0.33075   0.58060  -0.50817   0.00000  Uiso   1.00
H991   H     0.32972   0.61372  -0.51182   0.00000  Uiso   1.00
H992   H     0.34267   0.58939  -0.50200   0.00000  Uiso   1.00
C993   C     0.31056   0.57364  -0.52111   0.00000  Uiso   1.00
N994   N     0.30438   0.57735  -0.52655   0.00000  Uiso   1.00
C995   C     0.30514   0.58626  -0.52747   0.00000  Uiso   1.00
N996   N     0.31124   0.59142  -0.52334   0.00000  Uiso   1.00
C997   C     0.31705   0.58699  -0.51811   0.00000  Uiso   1.00
N998   N     0.31710   0.57810  -0.51680   0.00000  Uiso   1.00
C999   C     0.28807   0.59962  -0.54540   0.00000  Uiso   1.00
C1000  C     0.28720   0.59024  -0.54385   0.00000  Uiso   1.00
C1001  C     0.29263   0.58582  -0.53799   0.00000  Uiso   1.00
C1002  C     0.29935   0.59058  -0.53322   0.00000  Uiso   1.00
C1003  C     0.30030   0.59993  -0.53464   0.00000  Uiso   1.00
C1004  C     0.29487   0.60424  -0.54053   0.00000  Uiso   1.00
H1005  H     0.29178   0.57860  -0.53707   0.00000  Uiso   1.00
H1006  H     0.30549   0.60378  -0.53117   0.00000  Uiso   1.00
H1007  H     0.28205   0.58640  -0.54741   0.00000  Uiso   1.00
H1008  H     0.29600   0.61142  -0.54159   0.00000  Uiso   1.00
C1009  C     0.47512   0.72119  -0.46057   0.00000  Uiso   1.00
C1010  C     0.47247   0.71312  -0.45620   0.00000  Uiso   1.00
C1011  C     0.47858   0.70702  -0.45331   0.00000  Uiso   1.00
C1012  C     0.48788   0.70863  -0.45454   0.00000  Uiso   1.00
C1013  C     0.49070   0.71684  -0.45845   0.00000  Uiso   1.00
C1014  C     0.48450   0.72292  -0.46130   0.00000  Uiso   1.00
H1015  H     0.47618   0.70079  -0.45029   0.00000  Uiso   1.00
H1016  H     0.49782   0.71827  -0.45946   0.00000  Uiso   1.00
C1017  C     0.46859   0.72689  -0.46467   0.00000  Uiso   1.00
C1018  C     0.46971   0.73637  -0.46516   0.00000  Uiso   1.00
C1019  C     0.46348   0.74170  -0.46917   0.00000  Uiso   1.00
C1020  C     0.45570   0.73785  -0.47307   0.00000  Uiso   1.00
C1021  C     0.45450   0.72842  -0.47273   0.00000  Uiso   1.00
C1022  C     0.46072   0.72317  -0.46866   0.00000  Uiso   1.00
H1023  H     0.46534   0.71156  -0.45539   0.00000  Uiso   1.00
H1024  H     0.48685   0.72900  -0.46467   0.00000  Uiso   1.00
H1025  H     0.47564   0.73951  -0.46219   0.00000  Uiso   1.00
H1026  H     0.46457   0.74895  -0.46935   0.00000  Uiso   1.00
H1027  H     0.44860   0.72524  -0.47569   0.00000  Uiso   1.00
H1028  H     0.45965   0.71591  -0.46861   0.00000  Uiso   1.00
C1029  C     0.53524   0.69946  -0.45923   0.00000  Uiso   1.00
C1030  C     0.52911   0.70669  -0.46033   0.00000  Uiso   1.00
C1031  C     0.52042   0.70607  -0.45764   0.00000  Uiso   1.00
C1032  C     0.51725   0.69810  -0.45351   0.00000  Uiso   1.00
C1033  C     0.52341   0.69106  -0.45175   0.00000  Uiso   1.00
C1034  C     0.53210   0.69180  -0.45443   0.00000  Uiso   1.00
C1035  C     0.50825   0.69695  -0.45179   0.00000  Uiso   1.00
N1036  N     0.50570   0.68900  -0.44839   0.00000  Uiso   1.00
C1037  C     0.49682   0.68809  -0.44717   0.00000  Uiso   1.00
N1038  N     0.49067   0.69438  -0.44902   0.00000  Uiso   1.00
C1039  C     0.49399   0.70206  -0.45235   0.00000  Uiso   1.00
N1040  N     0.50270   0.70373  -0.45392   0.00000  Uiso   1.00
H1041  H     0.51586   0.71165  -0.45903   0.00000  Uiso   1.00
H1042  H     0.52122   0.68486  -0.44853   0.00000  Uiso   1.00
H1043  H     0.53121   0.71274  -0.46391   0.00000  Uiso   1.00
H1044  H     0.53649   0.68600  -0.45348   0.00000  Uiso   1.00
C1045  C     0.48752   0.66326  -0.43771   0.00000  Uiso   1.00
C1046  C     0.49686   0.66497  -0.43893   0.00000  Uiso   1.00
C1047  C     0.49990   0.67302  -0.44193   0.00000  Uiso   1.00
C1048  C     0.49377   0.68000  -0.44392   0.00000  Uiso   1.00
C1049  C     0.48444   0.67848  -0.44272   0.00000  Uiso   1.00
C1050  C     0.48145   0.67037  -0.43980   0.00000  Uiso   1.00
H1051  H     0.50712   0.67398  -0.44285   0.00000  Uiso   1.00
H1052  H     0.47955   0.68372  -0.44423   0.00000  Uiso   1.00
H1053  H     0.50172   0.65966  -0.43755   0.00000  Uiso   1.00
H1054  H     0.47423   0.66935  -0.43892   0.00000  Uiso   1.00
C1055  C     0.44784   0.78454  -0.48301   0.00000  Uiso   1.00
C1056  C     0.43997   0.78037  -0.48652   0.00000  Uiso   1.00
C1057  C     0.43873   0.77135  -0.48598   0.00000  Uiso   1.00
C1058  C     0.44529   0.76588  -0.48179   0.00000  Uiso   1.00
C1059  C     0.45311   0.76992  -0.47815   0.00000  Uiso   1.00
C1060  C     0.45432   0.77892  -0.47881   0.00000  Uiso   1.00
H1061  H     0.43265   0.76842  -0.48885   0.00000  Uiso   1.00
H1062  H     0.45828   0.76587  -0.47489   0.00000  Uiso   1.00
H1063  H     0.43486   0.78442  -0.48989   0.00000  Uiso   1.00
H1064  H     0.46042   0.78186  -0.47597   0.00000  Uiso   1.00
C1065  C     0.44933   0.74312  -0.47717   0.00000  Uiso   1.00
N1066  N     0.44224   0.73891  -0.48075   0.00000  Uiso   1.00
C1067  C     0.43618   0.74430  -0.48467   0.00000  Uiso   1.00
N1068  N     0.43677   0.75327  -0.48515   0.00000  Uiso   1.00
C1069  C     0.44419   0.75673  -0.48138   0.00000  Uiso   1.00
N1070  N     0.45070   0.75201  -0.47731   0.00000  Uiso   1.00
C1071  C     0.41427   0.73150  -0.49683   0.00000  Uiso   1.00
C1072  C     0.42120   0.72656  -0.49247   0.00000  Uiso   1.00
C1073  C     0.42821   0.73071  -0.48841   0.00000  Uiso   1.00
C1074  C     0.42888   0.74020  -0.48855   0.00000  Uiso   1.00
C1075  C     0.42208   0.74526  -0.49287   0.00000  Uiso   1.00
C1076  C     0.41505   0.74102  -0.49685   0.00000  Uiso   1.00
H1077  H     0.43336   0.72660  -0.48520   0.00000  Uiso   1.00
H1078  H     0.42243   0.75258  -0.49309   0.00000  Uiso   1.00
H1079  H     0.42107   0.71923  -0.49241   0.00000  Uiso   1.00
H1080  H     0.40989   0.74511  -0.50009   0.00000  Uiso   1.00
C1081  C     0.30665   0.71672  -0.60421   0.00000  Uiso   1.00
C1082  C     0.29970   0.72198  -0.60813   0.00000  Uiso   1.00
C1083  C     0.29226   0.71815  -0.61174   0.00000  Uiso   1.00
C1084  C     0.29123   0.70869  -0.61163   0.00000  Uiso   1.00
C1085  C     0.29805   0.70332  -0.60772   0.00000  Uiso   1.00
C1086  C     0.30544   0.70723  -0.60410   0.00000  Uiso   1.00
H1087  H     0.28712   0.72247  -0.61469   0.00000  Uiso   1.00
H1088  H     0.29746   0.69602  -0.60755   0.00000  Uiso   1.00
C1089  C     0.31466   0.72077  -0.60083   0.00000  Uiso   1.00
C1090  C     0.31940   0.71704  -0.59341   0.00000  Uiso   1.00
C1091  C     0.32714   0.72076  -0.59033   0.00000  Uiso   1.00
C1092  C     0.33070   0.72852  -0.59453   0.00000  Uiso   1.00
C1093  C     0.32608   0.73234  -0.60191   0.00000  Uiso   1.00
C1094  C     0.31832   0.72860  -0.60491   0.00000  Uiso   1.00
H1095  H     0.30029   0.72930  -0.60830   0.00000  Uiso   1.00
H1096  H     0.31065   0.70290  -0.60127   0.00000  Uiso   1.00
H1097  H     0.31680   0.71107  -0.59003   0.00000  Uiso   1.00
H1098  H     0.33054   0.71766  -0.58462   0.00000  Uiso   1.00
H1099  H     0.32865   0.73832  -0.60531   0.00000  Uiso   1.00
H1100  H     0.31500   0.73162  -0.61070   0.00000  Uiso   1.00
C1101  C     0.27370   0.66430  -0.61942   0.00000  Uiso   1.00
C1102  C     0.28118   0.66866  -0.61533   0.00000  Uiso   1.00
C1103  C     0.28186   0.67774  -0.61507   0.00000  Uiso   1.00
C1104  C     0.27500   0.68314  -0.61884   0.00000  Uiso   1.00
C1105  C     0.26744   0.67896  -0.62283   0.00000  Uiso   1.00
C1106  C     0.26686   0.66986  -0.62314   0.00000  Uiso   1.00
C1107  C     0.27579   0.69234  -0.61876   0.00000  Uiso   1.00
N1108  N     0.26911   0.69711  -0.62245   0.00000  Uiso   1.00
C1109  C     0.27030   0.70604  -0.62221   0.00000  Uiso   1.00
N1110  N     0.27745   0.71025  -0.61873   0.00000  Uiso   1.00
C1111  C     0.28370   0.70478  -0.61525   0.00000  Uiso   1.00
N1112  N     0.28322   0.69580  -0.61504   0.00000  Uiso   1.00
H1113  H     0.28777   0.68076  -0.61196   0.00000  Uiso   1.00
H1114  H     0.26205   0.68296  -0.62579   0.00000  Uiso   1.00
H1115  H     0.28664   0.66466  -0.61250   0.00000  Uiso   1.00
H1116  H     0.26098   0.66680  -0.62629   0.00000  Uiso   1.00
C1117  C     0.25004   0.72197  -0.63351   0.00000  Uiso   1.00
C1118  C     0.24942   0.71244  -0.63345   0.00000  Uiso   1.00
C1119  C     0.25595   0.70724  -0.62976   0.00000  Uiso   1.00
C1120  C     0.26364   0.71128  -0.62587   0.00000  Uiso   1.00
C1121  C     0.26438   0.72076  -0.62583   0.00000  Uiso   1.00
C1122  C     0.25780   0.72588  -0.62953   0.00000  Uiso   1.00
H1123  H     0.25518   0.69995  -0.62990   0.00000  Uiso   1.00
H1124  H     0.27020   0.72407  -0.62286   0.00000  Uiso   1.00
H1125  H     0.24366   0.70909  -0.63651   0.00000  Uiso   1.00
H1126  H     0.25855   0.73317  -0.62933   0.00000  Uiso   1.00
C1127  C     0.36384   0.72185  -0.55965   0.00000  Uiso   1.00
C1128  C     0.36727   0.72934  -0.56447   0.00000  Uiso   1.00
C1129  C     0.36294   0.73279  -0.57171   0.00000  Uiso   1.00
C1130  C     0.35480   0.72888  -0.57473   0.00000  Uiso   1.00
C1131  C     0.35134   0.72130  -0.57013   0.00000  Uiso   1.00
C1132  C     0.35572   0.71797  -0.56286   0.00000  Uiso   1.00
H1133  H     0.36581   0.73862  -0.57512   0.00000  Uiso   1.00
H1134  H     0.34508   0.71813  -0.57228   0.00000  Uiso   1.00
H1135  H     0.37356   0.73252  -0.56239   0.00000  Uiso   1.00
H1136  H     0.35271   0.71226  -0.55936   0.00000  Uiso   1.00
C1137  C     0.33856   0.73231  -0.59152   0.00000  Uiso   1.00
N1138  N     0.34148   0.73963  -0.59587   0.00000  Uiso   1.00
C1139  C     0.34915   0.74310  -0.59269   0.00000  Uiso   1.00
N1140  N     0.35386   0.73981  -0.58577   0.00000  Uiso   1.00
C1141  C     0.35029   0.73248  -0.58193   0.00000  Uiso   1.00
N1142  N     0.34265   0.72845  -0.58449   0.00000  Uiso   1.00
C1143  C     0.35817   0.76696  -0.60451   0.00000  Uiso   1.00
C1144  C     0.35042   0.76242  -0.60775   0.00000  Uiso   1.00
C1145  C     0.34757   0.75460  -0.60407   0.00000  Uiso   1.00
C1146  C     0.35236   0.75070  -0.59681   0.00000  Uiso   1.00
C1147  C     0.36027   0.75494  -0.59367   0.00000  Uiso   1.00
C1148  C     0.36306   0.76278  -0.59743   0.00000  Uiso   1.00
H1149  H     0.34146   0.75148  -0.60667   0.00000  Uiso   1.00
H1150  H     0.36410   0.75211  -0.58810   0.00000  Uiso   1.00
H1151  H     0.34650   0.76531  -0.61324   0.00000  Uiso   1.00
H1152  H     0.36900   0.76606  -0.59463   0.00000  Uiso   1.00
C1153  C     0.57974   0.62538  -0.51049   0.00000  Uiso   1.00
C1154  C     0.57170   0.62712  -0.50559   0.00000  Uiso   1.00
C1155  C     0.56630   0.62036  -0.50275   0.00000  Uiso   1.00
C1156  C     0.56854   0.61132  -0.50469   0.00000  Uiso   1.00
C1157  C     0.57658   0.60942  -0.50944   0.00000  Uiso   1.00
C1158  C     0.58198   0.61623  -0.51218   0.00000  Uiso   1.00
H1159  H     0.56017   0.62204  -0.49909   0.00000  Uiso   1.00
H1160  H     0.57846   0.60252  -0.51103   0.00000  Uiso   1.00
C1161  C     0.58515   0.63258  -0.51372   0.00000  Uiso   1.00
C1162  C     0.59471   0.63204  -0.51375   0.00000  Uiso   1.00
C1163  C     0.59984   0.63905  -0.51653   0.00000  Uiso   1.00
C1164  C     0.59572   0.64707  -0.51961   0.00000  Uiso   1.00
C1165  C     0.58623   0.64765  -0.51982   0.00000  Uiso   1.00
C1166  C     0.58116   0.64066  -0.51693   0.00000  Uiso   1.00
H1167  H     0.56978   0.63404  -0.50406   0.00000  Uiso   1.00
H1168  H     0.58806   0.61461  -0.51597   0.00000  Uiso   1.00
H1169  H     0.59803   0.62598  -0.51130   0.00000  Uiso   1.00
H1170  H     0.60714   0.63841  -0.51631   0.00000  Uiso   1.00
H1171  H     0.58287   0.65374  -0.52216   0.00000  Uiso   1.00
H1172  H     0.57385   0.64131  -0.51711   0.00000  Uiso   1.00
C1173  C     0.56484   0.56279  -0.50738   0.00000  Uiso   1.00
C1174  C     0.57073   0.56972  -0.51031   0.00000  Uiso   1.00
C1175  C     0.56915   0.57850  -0.50833   0.00000  Uiso   1.00
C1176  C     0.56144   0.58096  -0.50331   0.00000  Uiso   1.00
C1177  C     0.55563   0.57413  -0.50015   0.00000  Uiso   1.00
C1178  C     0.55741   0.56540  -0.50198   0.00000  Uiso   1.00
C1179  C     0.55944   0.58979  -0.50152   0.00000  Uiso   1.00
N1180  N     0.55168   0.59138  -0.49721   0.00000  Uiso   1.00
C1181  C     0.54993   0.60006  -0.49561   0.00000  Uiso   1.00
N1182  N     0.55530   0.60691  -0.49784   0.00000  Uiso   1.00
C1183  C     0.56287   0.60452  -0.50213   0.00000  Uiso   1.00
N1184  N     0.56527   0.59608  -0.50421   0.00000  Uiso   1.00
H1185  H     0.57377   0.58362  -0.51082   0.00000  Uiso   1.00
H1186  H     0.54970   0.57575  -0.49613   0.00000  Uiso   1.00
H1187  H     0.57655   0.56810  -0.51447   0.00000  Uiso   1.00
H1188  H     0.55279   0.56038  -0.49928   0.00000  Uiso   1.00
C1189  C     0.52469   0.60616  -0.48475   0.00000  Uiso   1.00
C1190  C     0.52740   0.59714  -0.48637   0.00000  Uiso   1.00
C1191  C     0.53568   0.59511  -0.48958   0.00000  Uiso   1.00
C1192  C     0.54189   0.60204  -0.49152   0.00000  Uiso   1.00
C1193  C     0.53946   0.61105  -0.48965   0.00000  Uiso   1.00
C1194  C     0.53118   0.61297  -0.48630   0.00000  Uiso   1.00
H1195  H     0.53732   0.58810  -0.49096   0.00000  Uiso   1.00
H1196  H     0.54410   0.61656  -0.49103   0.00000  Uiso   1.00
H1197  H     0.52265   0.59162  -0.48547   0.00000  Uiso   1.00
H1198  H     0.52949   0.62001  -0.48513   0.00000  Uiso   1.00
C1199  C     0.64248   0.65945  -0.52242   0.00000  Uiso   1.00
C1200  C     0.63802   0.66751  -0.52503   0.00000  Uiso   1.00
C1201  C     0.62893   0.66792  -0.52564   0.00000  Uiso   1.00
C1202  C     0.62365   0.66030  -0.52348   0.00000  Uiso   1.00
C1203  C     0.62794   0.65224  -0.52079   0.00000  Uiso   1.00
C1204  C     0.63704   0.65182  -0.52043   0.00000  Uiso   1.00
H1205  H     0.62579   0.67421  -0.52772   0.00000  Uiso   1.00
H1206  H     0.62404   0.64626  -0.51911   0.00000  Uiso   1.00
H1207  H     0.64196   0.67349  -0.52665   0.00000  Uiso   1.00
H1208  H     0.64022   0.64554  -0.51837   0.00000  Uiso   1.00
C1209  C     0.60086   0.65429  -0.52219   0.00000  Uiso   1.00
N1210  N     0.59651   0.66163  -0.52509   0.00000  Uiso   1.00
C1211  C     0.60186   0.66847  -0.52745   0.00000  Uiso   1.00
N1212  N     0.61085   0.66844  -0.52697   0.00000  Uiso   1.00
C1213  C     0.61444   0.66074  -0.52402   0.00000  Uiso   1.00
N1214  N     0.60980   0.65342  -0.52159   0.00000  Uiso   1.00
C1215  C     0.58982   0.69102  -0.53920   0.00000  Uiso   1.00
C1216  C     0.58458   0.68372  -0.53598   0.00000  Uiso   1.00
C1217  C     0.58840   0.67651  -0.53189   0.00000  Uiso   1.00
C1218  C     0.59784   0.67608  -0.53080   0.00000  Uiso   1.00
C1219  C     0.60316   0.68342  -0.53371   0.00000  Uiso   1.00
C1220  C     0.59926   0.69059  -0.53776   0.00000  Uiso   1.00
H1221  H     0.58410   0.67098  -0.52971   0.00000  Uiso   1.00
H1222  H     0.61046   0.68329  -0.53299   0.00000  Uiso   1.00
H1223  H     0.57729   0.68377  -0.53685   0.00000  Uiso   1.00
H1224  H     0.60362   0.69596  -0.54022   0.00000  Uiso   1.00
C1225  C     0.46440   0.76718  -0.43579   0.00000  Uiso   1.00
C1226  C     0.45784   0.76062  -0.43810   0.00000  Uiso   1.00
C1227  C     0.44904   0.76172  -0.43599   0.00000  Uiso   1.00
C1228  C     0.44615   0.76952  -0.43136   0.00000  Uiso   1.00
C1229  C     0.45256   0.77616  -0.42905   0.00000  Uiso   1.00
C1230  C     0.46134   0.77502  -0.43123   0.00000  Uiso   1.00
H1231  H     0.44426   0.75648  -0.43787   0.00000  Uiso   1.00
H1232  H     0.45056   0.78224  -0.42547   0.00000  Uiso   1.00
C1233  C     0.47371   0.76587  -0.43773   0.00000  Uiso   1.00
C1234  C     0.47942   0.77324  -0.43983   0.00000  Uiso   1.00
C1235  C     0.48836   0.77210  -0.44125   0.00000  Uiso   1.00
C1236  C     0.49225   0.76344  -0.44060   0.00000  Uiso   1.00
C1237  C     0.48666   0.75600  -0.43863   0.00000  Uiso   1.00
C1238  C     0.47772   0.75720  -0.43730   0.00000  Uiso   1.00
H1239  H     0.45986   0.75453  -0.44167   0.00000  Uiso   1.00
H1240  H     0.46614   0.78019  -0.42922   0.00000  Uiso   1.00
H1241  H     0.47664   0.78001  -0.44032   0.00000  Uiso   1.00
H1242  H     0.49248   0.77798  -0.44276   0.00000  Uiso   1.00
H1243  H     0.48946   0.74924  -0.43807   0.00000  Uiso   1.00
H1244  H     0.47362   0.75135  -0.43559   0.00000  Uiso   1.00
C1245  C     0.41814   0.80185  -0.40910   0.00000  Uiso   1.00
C1246  C     0.42714   0.80074  -0.41135   0.00000  Uiso   1.00
C1247  C     0.42990   0.79315  -0.41583   0.00000  Uiso   1.00
C1248  C     0.42357   0.78643  -0.41815   0.00000  Uiso   1.00
C1249  C     0.41443   0.78768  -0.41579   0.00000  Uiso   1.00
C1250  C     0.41184   0.79533  -0.41131   0.00000  Uiso   1.00
C1251  C     0.42626   0.77885  -0.42265   0.00000  Uiso   1.00
N1252  N     0.41994   0.77275  -0.42466   0.00000  Uiso   1.00
C1253  C     0.42299   0.76549  -0.42903   0.00000  Uiso   1.00
N1254  N     0.43156   0.76406  -0.43142   0.00000  Uiso   1.00
C1255  C     0.43727   0.77061  -0.42908   0.00000  Uiso   1.00
N1256  N     0.43502   0.77814  -0.42469   0.00000  Uiso   1.00
H1257  H     0.43700   0.79242  -0.41753   0.00000  Uiso   1.00
H1258  H     0.40936   0.78266  -0.41745   0.00000  Uiso   1.00
H1259  H     0.43200   0.80592  -0.40956   0.00000  Uiso   1.00
H1260  H     0.40481   0.79632  -0.40949   0.00000  Uiso   1.00
C1261  C     0.40441   0.74583  -0.43586   0.00000  Uiso   1.00
C1262  C     0.40158   0.75350  -0.43135   0.00000  Uiso   1.00
C1263  C     0.40765   0.76006  -0.42903   0.00000  Uiso   1.00
C1264  C     0.41685   0.75900  -0.43127   0.00000  Uiso   1.00
C1265  C     0.41962   0.75112  -0.43585   0.00000  Uiso   1.00
C1266  C     0.41340   0.74467  -0.43808   0.00000  Uiso   1.00
H1267  H     0.40527   0.76602  -0.42551   0.00000  Uiso   1.00
H1268  H     0.42664   0.75006  -0.43767   0.00000  Uiso   1.00
H1269  H     0.39448   0.75431  -0.42967   0.00000  Uiso   1.00
H1270  H     0.41552   0.73860  -0.44161   0.00000  Uiso   1.00
C1271  C     0.53133   0.79030  -0.44942   0.00000  Uiso   1.00
C1272  C     0.53516   0.78182  -0.44871   0.00000  Uiso   1.00
C1273  C     0.52986   0.77443  -0.44712   0.00000  Uiso   1.00
C1274  C     0.52044   0.77548  -0.44617   0.00000  Uiso   1.00
C1275  C     0.51664   0.78418  -0.44695   0.00000  Uiso   1.00
C1276  C     0.52210   0.79144  -0.44854   0.00000  Uiso   1.00
H1277  H     0.53302   0.76784  -0.44656   0.00000  Uiso   1.00
H1278  H     0.50943   0.78524  -0.44625   0.00000  Uiso   1.00
H1279  H     0.54242   0.78104  -0.44941   0.00000  Uiso   1.00
H1280  H     0.51921   0.79816  -0.44911   0.00000  Uiso   1.00
C1281  C     0.50134   0.76232  -0.44172   0.00000  Uiso   1.00
N1282  N     0.50462   0.75398  -0.44084   0.00000  Uiso   1.00
C1283  C     0.51355   0.75331  -0.44189   0.00000  Uiso   1.00
N1284  N     0.51911   0.76016  -0.44368   0.00000  Uiso   1.00
C1285  C     0.51508   0.76818  -0.44441   0.00000  Uiso   1.00
N1286  N     0.50624   0.76967  -0.44350   0.00000  Uiso   1.00
C1287  C     0.52519   0.72822  -0.43695   0.00000  Uiso   1.00
C1288  C     0.51571   0.72942  -0.43674   0.00000  Uiso   1.00
C1289  C     0.51188   0.73748  -0.43859   0.00000  Uiso   1.00
C1290  C     0.51732   0.74495  -0.44083   0.00000  Uiso   1.00
C1291  C     0.52674   0.74379  -0.44150   0.00000  Uiso   1.00
C1292  C     0.53049   0.73569  -0.43963   0.00000  Uiso   1.00
H1293  H     0.50460   0.73815  -0.43804   0.00000  Uiso   1.00
H1294  H     0.53112   0.74940  -0.44326   0.00000  Uiso   1.00
H1295  H     0.51134   0.72392  -0.43461   0.00000  Uiso   1.00
H1296  H     0.53780   0.73507  -0.44001   0.00000  Uiso   1.00
H1297  H     0.41602   0.80790  -0.40555   0.00000  Uiso   1.00
H1298  H     0.39953   0.74067  -0.43767   0.00000  Uiso   1.00
H1299  H     0.53560   0.79612  -0.45067   0.00000  Uiso   1.00
C1300  C     0.49685   0.84650  -0.49839   0.00000  Uiso   1.00
C1301  C     0.50490   0.84238  -0.49528   0.00000  Uiso   1.00
C1302  C     0.51312   0.84544  -0.49779   0.00000  Uiso   1.00
C1303  C     0.51386   0.85285  -0.50371   0.00000  Uiso   1.00
C1304  C     0.50594   0.85706  -0.50688   0.00000  Uiso   1.00
C1305  C     0.49776   0.85399  -0.50427   0.00000  Uiso   1.00
H1306  H     0.51909   0.84205  -0.49523   0.00000  Uiso   1.00
H1307  H     0.50628   0.86278  -0.51146   0.00000  Uiso   1.00
C1308  C     0.48822   0.84318  -0.49581   0.00000  Uiso   1.00
C1309  C     0.48078   0.84905  -0.49459   0.00000  Uiso   1.00
C1310  C     0.47253   0.84591  -0.49229   0.00000  Uiso   1.00
C1311  C     0.47112   0.83658  -0.49111   0.00000  Uiso   1.00
C1312  C     0.47844   0.83061  -0.49225   0.00000  Uiso   1.00
C1313  C     0.48668   0.83383  -0.49449   0.00000  Uiso   1.00
H1314  H     0.50454   0.83667  -0.49069   0.00000  Uiso   1.00
H1315  H     0.49177   0.85731  -0.50692   0.00000  Uiso   1.00
H1316  H     0.48164   0.85629  -0.49545   0.00000  Uiso   1.00
H1317  H     0.46702   0.85068  -0.49145   0.00000  Uiso   1.00
H1318  H     0.47757   0.82338  -0.49141   0.00000  Uiso   1.00
H1319  H     0.49216   0.82904  -0.49544   0.00000  Uiso   1.00
C1320  C     0.53253   0.88693  -0.53227   0.00000  Uiso   1.00
C1321  C     0.52414   0.88397  -0.52945   0.00000  Uiso   1.00
C1322  C     0.52343   0.87690  -0.52356   0.00000  Uiso   1.00
C1323  C     0.53130   0.87259  -0.52035   0.00000  Uiso   1.00
C1324  C     0.53980   0.87571  -0.52329   0.00000  Uiso   1.00
C1325  C     0.54032   0.88280  -0.52918   0.00000  Uiso   1.00
C1326  C     0.53066   0.86549  -0.51451   0.00000  Uiso   1.00
N1327  N     0.53835   0.86172  -0.51171   0.00000  Uiso   1.00
C1328  C     0.53730   0.85480  -0.50605   0.00000  Uiso   1.00
N1329  N     0.52938   0.85158  -0.50317   0.00000  Uiso   1.00
C1330  C     0.52217   0.85588  -0.50641   0.00000  Uiso   1.00
N1331  N     0.52239   0.86287  -0.51207   0.00000  Uiso   1.00
H1332  H     0.51677   0.87468  -0.52145   0.00000  Uiso   1.00
H1333  H     0.54601   0.87256  -0.52097   0.00000  Uiso   1.00
H1334  H     0.51810   0.88729  -0.53193   0.00000  Uiso   1.00
H1335  H     0.54685   0.88520  -0.53147   0.00000  Uiso   1.00
C1336  C     0.56036   0.84225  -0.49661   0.00000  Uiso   1.00
C1337  C     0.56110   0.84946  -0.50248   0.00000  Uiso   1.00
C1338  C     0.55354   0.85368  -0.50567   0.00000  Uiso   1.00
C1339  C     0.54492   0.85065  -0.50295   0.00000  Uiso   1.00
C1340  C     0.54430   0.84328  -0.49695   0.00000  Uiso   1.00
C1341  C     0.55198   0.83918  -0.49387   0.00000  Uiso   1.00
H1342  H     0.55429   0.85933  -0.51028   0.00000  Uiso   1.00
H1343  H     0.53779   0.84076  -0.49471   0.00000  Uiso   1.00
H1344  H     0.56774   0.85178  -0.50456   0.00000  Uiso   1.00
H1345  H     0.55150   0.83351  -0.48926   0.00000  Uiso   1.00
C1346  C     0.42679   0.85358  -0.48264   0.00000  Uiso   1.00
C1347  C     0.42534   0.84440  -0.48172   0.00000  Uiso   1.00
C1348  C     0.43231   0.83845  -0.48285   0.00000  Uiso   1.00
C1349  C     0.44101   0.84169  -0.48497   0.00000  Uiso   1.00
C1350  C     0.44236   0.85108  -0.48587   0.00000  Uiso   1.00
C1351  C     0.43528   0.85687  -0.48470   0.00000  Uiso   1.00
H1352  H     0.43101   0.83128  -0.48209   0.00000  Uiso   1.00
H1353  H     0.44897   0.85381  -0.48747   0.00000  Uiso   1.00
H1354  H     0.41864   0.84194  -0.48009   0.00000  Uiso   1.00
H1355  H     0.43631   0.86410  -0.48540   0.00000  Uiso   1.00
C1356  C     0.46272   0.83334  -0.48902   0.00000  Uiso   1.00
N1357  N     0.46180   0.82443  -0.48816   0.00000  Uiso   1.00
C1358  C     0.45343   0.82168  -0.48627   0.00000  Uiso   1.00
N1359  N     0.44630   0.82705  -0.48517   0.00000  Uiso   1.00
C1360  C     0.44804   0.83584  -0.48610   0.00000  Uiso   1.00
N1361  N     0.45609   0.83937  -0.48806   0.00000  Uiso   1.00
C1362  C     0.44924   0.79398  -0.48379   0.00000  Uiso   1.00
C1363  C     0.45794   0.79756  -0.48547   0.00000  Uiso   1.00
C1364  C     0.45933   0.80653  -0.48631   0.00000  Uiso   1.00
C1365  C     0.45205   0.81259  -0.48539   0.00000  Uiso   1.00
C1366  C     0.44334   0.80917  -0.48363   0.00000  Uiso   1.00
C1367  C     0.44200   0.80018  -0.48293   0.00000  Uiso   1.00
H1368  H     0.46611   0.80896  -0.48766   0.00000  Uiso   1.00
H1369  H     0.43760   0.81368  -0.48291   0.00000  Uiso   1.00
H1370  H     0.46367   0.79303  -0.48627   0.00000  Uiso   1.00
H1371  H     0.43522   0.79772  -0.48155   0.00000  Uiso   1.00
H1372  H     0.53302   0.89256  -0.53695   0.00000  Uiso   1.00
H1373  H     0.56642   0.83896  -0.49411   0.00000  Uiso   1.00
H1374  H     0.42121   0.85825  -0.48173   0.00000  Uiso   1.00
C1375  C     0.41366   0.82406  -0.61854   0.00000  Uiso   1.00
C1376  C     0.41992   0.82090  -0.61203   0.00000  Uiso   1.00
C1377  C     0.42856   0.82383  -0.61190   0.00000  Uiso   1.00
C1378  C     0.43156   0.83014  -0.61836   0.00000  Uiso   1.00
C1379  C     0.42546   0.83331  -0.62493   0.00000  Uiso   1.00
C1380  C     0.41684   0.83036  -0.62498   0.00000  Uiso   1.00
H1381  H     0.43310   0.82127  -0.60675   0.00000  Uiso   1.00
H1382  H     0.42758   0.83816  -0.63002   0.00000  Uiso   1.00
C1383  C     0.40454   0.82108  -0.61856   0.00000  Uiso   1.00
C1384  C     0.39743   0.82690  -0.62119   0.00000  Uiso   1.00
C1385  C     0.38875   0.82412  -0.62122   0.00000  Uiso   1.00
C1386  C     0.38656   0.81523  -0.61862   0.00000  Uiso   1.00
C1387  C     0.39354   0.80932  -0.61599   0.00000  Uiso   1.00
C1388  C     0.40219   0.81218  -0.61595   0.00000  Uiso   1.00
H1389  H     0.41778   0.81613  -0.60689   0.00000  Uiso   1.00
H1390  H     0.41231   0.83290  -0.63017   0.00000  Uiso   1.00
H1391  H     0.39888   0.83382  -0.62315   0.00000  Uiso   1.00
H1392  H     0.38352   0.82884  -0.62327   0.00000  Uiso   1.00
H1393  H     0.39206   0.80243  -0.61396   0.00000  Uiso   1.00
H1394  H     0.40743   0.80745  -0.61395   0.00000  Uiso   1.00
C1395  C     0.45954   0.86056  -0.64313   0.00000  Uiso   1.00
C1396  C     0.45072   0.85748  -0.64321   0.00000  Uiso   1.00
C1397  C     0.44788   0.85132  -0.63695   0.00000  Uiso   1.00
C1398  C     0.45397   0.84809  -0.63037   0.00000  Uiso   1.00
C1399  C     0.46294   0.85130  -0.63039   0.00000  Uiso   1.00
C1400  C     0.46560   0.85746  -0.63673   0.00000  Uiso   1.00
C1401  C     0.45120   0.84194  -0.62409   0.00000  Uiso   1.00
N1402  N     0.45725   0.83918  -0.61803   0.00000  Uiso   1.00
C1403  C     0.45413   0.83318  -0.61207   0.00000  Uiso   1.00
N1404  N     0.44572   0.82995  -0.61185   0.00000  Uiso   1.00
C1405  C     0.44028   0.83320  -0.61823   0.00000  Uiso   1.00
N1406  N     0.44263   0.83920  -0.62452   0.00000  Uiso   1.00
H1407  H     0.44093   0.84901  -0.63714   0.00000  Uiso   1.00
H1408  H     0.46780   0.84896  -0.62543   0.00000  Uiso   1.00
H1409  H     0.44605   0.85998  -0.64827   0.00000  Uiso   1.00
H1410  H     0.47250   0.85994  -0.63677   0.00000  Uiso   1.00
C1411  C     0.47194   0.82382  -0.59275   0.00000  Uiso   1.00
C1412  C     0.47483   0.83006  -0.59905   0.00000  Uiso   1.00
C1413  C     0.46902   0.83322  -0.60549   0.00000  Uiso   1.00
C1414  C     0.46002   0.83010  -0.60569   0.00000  Uiso   1.00
C1415  C     0.45718   0.82373  -0.59919   0.00000  Uiso   1.00
C1416  C     0.46314   0.82068  -0.59284   0.00000  Uiso   1.00
H1417  H     0.47144   0.83812  -0.61037   0.00000  Uiso   1.00
H1418  H     0.45032   0.82118  -0.59914   0.00000  Uiso   1.00
H1419  H     0.48176   0.83246  -0.59888   0.00000  Uiso   1.00
H1420  H     0.46098   0.81578  -0.58785   0.00000  Uiso   1.00
C1421  C     0.34289   0.83308  -0.62851   0.00000  Uiso   1.00
C1422  C     0.34068   0.82436  -0.62599   0.00000  Uiso   1.00
C1423  C     0.34729   0.81842  -0.62349   0.00000  Uiso   1.00
C1424  C     0.35640   0.82120  -0.62349   0.00000  Uiso   1.00
C1425  C     0.35852   0.83011  -0.62609   0.00000  Uiso   1.00
C1426  C     0.35178   0.83591  -0.62855   0.00000  Uiso   1.00
H1427  H     0.34540   0.81162  -0.62153   0.00000  Uiso   1.00
H1428  H     0.36546   0.83248  -0.62615   0.00000  Uiso   1.00
H1429  H     0.33366   0.82225  -0.62600   0.00000  Uiso   1.00
H1430  H     0.35340   0.84277  -0.63055   0.00000  Uiso   1.00
C1431  C     0.37776   0.81242  -0.61861   0.00000  Uiso   1.00
N1432  N     0.37610   0.80394  -0.61607   0.00000  Uiso   1.00
C1433  C     0.36740   0.80163  -0.61618   0.00000  Uiso   1.00
N1434  N     0.36060   0.80704  -0.61858   0.00000  Uiso   1.00
C1435  C     0.36308   0.81534  -0.62099   0.00000  Uiso   1.00
N1436  N     0.37154   0.81842  -0.62115   0.00000  Uiso   1.00
C1437  C     0.36061   0.77563  -0.60784   0.00000  Uiso   1.00
C1438  C     0.36971   0.77854  -0.60809   0.00000  Uiso   1.00
C1439  C     0.37198   0.78692  -0.61085   0.00000  Uiso   1.00
C1440  C     0.36522   0.79304  -0.61359   0.00000  Uiso   1.00
C1441  C     0.35612   0.79026  -0.61348   0.00000  Uiso   1.00
C1442  C     0.35394   0.78185  -0.61072   0.00000  Uiso   1.00
H1443  H     0.37904   0.78888  -0.61087   0.00000  Uiso   1.00
H1444  H     0.35075   0.79481  -0.61552   0.00000  Uiso   1.00
H1445  H     0.37507   0.77398  -0.60599   0.00000  Uiso   1.00
H1446  H     0.34684   0.78000  -0.61051   0.00000  Uiso   1.00
H1447  H     0.46172   0.86544  -0.64813   0.00000  Uiso   1.00
H1448  H     0.47662   0.82135  -0.58767   0.00000  Uiso   1.00
H1449  H     0.33759   0.83774  -0.63049   0.00000  Uiso   1.00
C1450  C     0.22818   0.78900  -0.67203   0.00000  Uiso   1.00
C1451  C     0.23508   0.79448  -0.66830   0.00000  Uiso   1.00
C1452  C     0.23745   0.80242  -0.67209   0.00000  Uiso   1.00
C1453  C     0.23308   0.80544  -0.67999   0.00000  Uiso   1.00
C1454  C     0.22620   0.80009  -0.68381   0.00000  Uiso   1.00
C1455  C     0.22384   0.79218  -0.67993   0.00000  Uiso   1.00
H1456  H     0.24278   0.80639  -0.66899   0.00000  Uiso   1.00
H1457  H     0.22272   0.80222  -0.68991   0.00000  Uiso   1.00
C1458  C     0.22580   0.78060  -0.66806   0.00000  Uiso   1.00
C1459  C     0.21679   0.77740  -0.66817   0.00000  Uiso   1.00
C1460  C     0.21451   0.76941  -0.66441   0.00000  Uiso   1.00
C1461  C     0.22116   0.76398  -0.66031   0.00000  Uiso   1.00
C1462  C     0.23018   0.76703  -0.66015   0.00000  Uiso   1.00
C1463  C     0.23237   0.77506  -0.66387   0.00000  Uiso   1.00
H1464  H     0.23854   0.79235  -0.66219   0.00000  Uiso   1.00
H1465  H     0.21858   0.78816  -0.68309   0.00000  Uiso   1.00
H1466  H     0.21150   0.78146  -0.67124   0.00000  Uiso   1.00
H1467  H     0.20750   0.76725  -0.66464   0.00000  Uiso   1.00
H1468  H     0.23546   0.76300  -0.65704   0.00000  Uiso   1.00
H1469  H     0.23939   0.77719  -0.66370   0.00000  Uiso   1.00
C1470  C     0.22105   0.83196  -0.71835   0.00000  Uiso   1.00
C1471  C     0.21852   0.82395  -0.71429   0.00000  Uiso   1.00
C1472  C     0.22268   0.82115  -0.70654   0.00000  Uiso   1.00
C1473  C     0.22958   0.82645  -0.70267   0.00000  Uiso   1.00
C1474  C     0.23206   0.83462  -0.70690   0.00000  Uiso   1.00
C1475  C     0.22780   0.83725  -0.71465   0.00000  Uiso   1.00
C1476  C     0.23380   0.82368  -0.69497   0.00000  Uiso   1.00
N1477  N     0.24027   0.82899  -0.69163   0.00000  Uiso   1.00
C1478  C     0.24415   0.82589  -0.68411   0.00000  Uiso   1.00
N1479  N     0.24206   0.81817  -0.67996   0.00000  Uiso   1.00
C1480  C     0.23550   0.81344  -0.68391   0.00000  Uiso   1.00
N1481  N     0.23113   0.81585  -0.69140   0.00000  Uiso   1.00
H1482  H     0.22059   0.81483  -0.70347   0.00000  Uiso   1.00
H1483  H     0.23735   0.83886  -0.70413   0.00000  Uiso   1.00
H1484  H     0.21321   0.81988  -0.71727   0.00000  Uiso   1.00
H1485  H     0.22971   0.84352  -0.71794   0.00000  Uiso   1.00
C1486  C     0.26436   0.84138  -0.67270   0.00000  Uiso   1.00
C1487  C     0.26013   0.84431  -0.68049   0.00000  Uiso   1.00
C1488  C     0.25343   0.83926  -0.68434   0.00000  Uiso   1.00
C1489  C     0.25082   0.83102  -0.68035   0.00000  Uiso   1.00
C1490  C     0.25521   0.82814  -0.67240   0.00000  Uiso   1.00
C1491  C     0.26188   0.83332  -0.66869   0.00000  Uiso   1.00
H1492  H     0.25020   0.84170  -0.69046   0.00000  Uiso   1.00
H1493  H     0.25338   0.82183  -0.66914   0.00000  Uiso   1.00
H1494  H     0.26216   0.85066  -0.68355   0.00000  Uiso   1.00
H1495  H     0.26527   0.83111  -0.66258   0.00000  Uiso   1.00
C1496  C     0.18202   0.73668  -0.65334   0.00000  Uiso   1.00
C1497  C     0.18858   0.73137  -0.64936   0.00000  Uiso   1.00
C1498  C     0.19738   0.73418  -0.64917   0.00000  Uiso   1.00
C1499  C     0.19976   0.74254  -0.65307   0.00000  Uiso   1.00
C1500  C     0.19297   0.74788  -0.65708   0.00000  Uiso   1.00
C1501  C     0.18424   0.74490  -0.65717   0.00000  Uiso   1.00
H1502  H     0.20241   0.72990  -0.64602   0.00000  Uiso   1.00
H1503  H     0.19455   0.75435  -0.66014   0.00000  Uiso   1.00
H1504  H     0.18673   0.72493  -0.64638   0.00000  Uiso   1.00
H1505  H     0.17900   0.74899  -0.66027   0.00000  Uiso   1.00
C1506  C     0.21893   0.75586  -0.65651   0.00000  Uiso   1.00
N1507  N     0.22559   0.75107  -0.65282   0.00000  Uiso   1.00
C1508  C     0.22304   0.74322  -0.64921   0.00000  Uiso   1.00
N1509  N     0.21462   0.74004  -0.64909   0.00000  Uiso   1.00
C1510  C     0.20852   0.74542  -0.65298   0.00000  Uiso   1.00
N1511  N     0.21028   0.75338  -0.65681   0.00000  Uiso   1.00
C1512  C     0.24314   0.72740  -0.63745   0.00000  Uiso   1.00
C1513  C     0.24516   0.73582  -0.64148   0.00000  Uiso   1.00
C1514  C     0.23867   0.74097  -0.64530   0.00000  Uiso   1.00
C1515  C     0.22962   0.73802  -0.64535   0.00000  Uiso   1.00
C1516  C     0.22747   0.72965  -0.64136   0.00000  Uiso   1.00
C1517  C     0.23402   0.72457  -0.63756   0.00000  Uiso   1.00
H1518  H     0.24056   0.74738  -0.64833   0.00000  Uiso   1.00
H1519  H     0.22056   0.72719  -0.64127   0.00000  Uiso   1.00
H1520  H     0.25207   0.73826  -0.64167   0.00000  Uiso   1.00
H1521  H     0.23211   0.71820  -0.63447   0.00000  Uiso   1.00
H1522  H     0.21771   0.83412  -0.72451   0.00000  Uiso   1.00
H1523  H     0.26966   0.84544  -0.66970   0.00000  Uiso   1.00
H1524  H     0.17506   0.73438  -0.65346   0.00000  Uiso   1.00
C1525  C     0.29032   0.59448  -0.58555   0.00000  Uiso   1.00
C1526  C     0.29698   0.59806  -0.57971   0.00000  Uiso   1.00
C1527  C     0.30004   0.59338  -0.57251   0.00000  Uiso   1.00
C1528  C     0.29662   0.58470  -0.57067   0.00000  Uiso   1.00
C1529  C     0.28974   0.58115  -0.57619   0.00000  Uiso   1.00
C1530  C     0.28676   0.58588  -0.58340   0.00000  Uiso   1.00
H1531  H     0.30533   0.59632  -0.56837   0.00000  Uiso   1.00
H1532  H     0.28696   0.57449  -0.57492   0.00000  Uiso   1.00
C1533  C     0.28750   0.59926  -0.59339   0.00000  Uiso   1.00
C1534  C     0.28490   0.59470  -0.60139   0.00000  Uiso   1.00
C1535  C     0.28224   0.59926  -0.60883   0.00000  Uiso   1.00
C1536  C     0.28189   0.60876  -0.60872   0.00000  Uiso   1.00
C1537  C     0.28465   0.61342  -0.60090   0.00000  Uiso   1.00
C1538  C     0.28729   0.60880  -0.59351   0.00000  Uiso   1.00
H1539  H     0.29996   0.60462  -0.58111   0.00000  Uiso   1.00
H1540  H     0.28154   0.58290  -0.58761   0.00000  Uiso   1.00
H1541  H     0.28510   0.58738  -0.60166   0.00000  Uiso   1.00
H1542  H     0.28016   0.59549  -0.61477   0.00000  Uiso   1.00
H1543  H     0.28442   0.62074  -0.60058   0.00000  Uiso   1.00
H1544  H     0.28916   0.61261  -0.58751   0.00000  Uiso   1.00
C1545  C     0.29084   0.54110  -0.55099   0.00000  Uiso   1.00
C1546  C     0.28689   0.54639  -0.55759   0.00000  Uiso   1.00
C1547  C     0.29026   0.55477  -0.55948   0.00000  Uiso   1.00
C1548  C     0.29772   0.55810  -0.55457   0.00000  Uiso   1.00
C1549  C     0.30172   0.55258  -0.54793   0.00000  Uiso   1.00
C1550  C     0.29825   0.54419  -0.54623   0.00000  Uiso   1.00
C1551  C     0.30091   0.56660  -0.55614   0.00000  Uiso   1.00
N1552  N     0.30780   0.56945  -0.55109   0.00000  Uiso   1.00
C1553  C     0.31058   0.57782  -0.55291   0.00000  Uiso   1.00
N1554  N     0.30708   0.58322  -0.55921   0.00000  Uiso   1.00
C1555  C     0.30028   0.57962  -0.56389   0.00000  Uiso   1.00
N1556  N     0.29688   0.57138  -0.56263   0.00000  Uiso   1.00
H1557  H     0.28703   0.55882  -0.56467   0.00000  Uiso   1.00
H1558  H     0.30752   0.55488  -0.54408   0.00000  Uiso   1.00
H1559  H     0.28109   0.54385  -0.56129   0.00000  Uiso   1.00
H1560  H     0.30130   0.53992  -0.54111   0.00000  Uiso   1.00
C1561  C     0.33144   0.58801  -0.53744   0.00000  Uiso   1.00
C1562  C     0.32846   0.57928  -0.53603   0.00000  Uiso   1.00
C1563  C     0.32164   0.57578  -0.54118   0.00000  Uiso   1.00
C1564  C     0.31761   0.58112  -0.54795   0.00000  Uiso   1.00
C1565  C     0.32084   0.58996  -0.54941   0.00000  Uiso   1.00
C1566  C     0.32764   0.59330  -0.54413   0.00000  Uiso   1.00
H1567  H     0.31936   0.56894  -0.53989   0.00000  Uiso   1.00
H1568  H     0.31795   0.59424  -0.55461   0.00000  Uiso   1.00
H1569  H     0.33152   0.57520  -0.53075   0.00000  Uiso   1.00
H1570  H     0.33009   0.60012  -0.54519   0.00000  Uiso   1.00
C1571  C     0.26249   0.60047  -0.65215   0.00000  Uiso   1.00
C1572  C     0.26190   0.60978  -0.65171   0.00000  Uiso   1.00
C1573  C     0.26509   0.61430  -0.64432   0.00000  Uiso   1.00
C1574  C     0.26898   0.60945  -0.63711   0.00000  Uiso   1.00
C1575  C     0.26955   0.59996  -0.63769   0.00000  Uiso   1.00
C1576  C     0.26631   0.59561  -0.64516   0.00000  Uiso   1.00
H1577  H     0.26453   0.62161  -0.64412   0.00000  Uiso   1.00
H1578  H     0.27250   0.59600  -0.63227   0.00000  Uiso   1.00
H1579  H     0.25887   0.61349  -0.65726   0.00000  Uiso   1.00
H1580  H     0.26673   0.58830  -0.64561   0.00000  Uiso   1.00
C1581  C     0.27845   0.61346  -0.61588   0.00000  Uiso   1.00
N1582  N     0.27804   0.62240  -0.61501   0.00000  Uiso   1.00
C1583  C     0.27441   0.62674  -0.62201   0.00000  Uiso   1.00
N1584  N     0.27132   0.62284  -0.62950   0.00000  Uiso   1.00
C1585  C     0.27210   0.61386  -0.62964   0.00000  Uiso   1.00
N1586  N     0.27560   0.60880  -0.62303   0.00000  Uiso   1.00
C1587  C     0.27326   0.65474  -0.61989   0.00000  Uiso   1.00
C1588  C     0.27674   0.64934  -0.61283   0.00000  Uiso   1.00
C1589  C     0.27705   0.64027  -0.61348   0.00000  Uiso   1.00
C1590  C     0.27383   0.63592  -0.62131   0.00000  Uiso   1.00
C1591  C     0.27014   0.64115  -0.62836   0.00000  Uiso   1.00
C1592  C     0.26982   0.65024  -0.62761   0.00000  Uiso   1.00
H1593  H     0.27989   0.63643  -0.60792   0.00000  Uiso   1.00
H1594  H     0.26761   0.63797  -0.63446   0.00000  Uiso   1.00
H1595  H     0.27937   0.65251  -0.60675   0.00000  Uiso   1.00
H1596  H     0.26718   0.65414  -0.63325   0.00000  Uiso   1.00
H1597  H     0.28809   0.53447  -0.54953   0.00000  Uiso   1.00
H1598  H     0.33680   0.59074  -0.53325   0.00000  Uiso   1.00
H1599  H     0.25993   0.59694  -0.65805   0.00000  Uiso   1.00
C1600  C     0.26376   0.67008  -0.57125   0.00000  Uiso   1.00
C1601  C     0.26085   0.67361  -0.56283   0.00000  Uiso   1.00
C1602  C     0.26086   0.68258  -0.56117   0.00000  Uiso   1.00
C1603  C     0.26389   0.68867  -0.56782   0.00000  Uiso   1.00
C1604  C     0.26678   0.68530  -0.57625   0.00000  Uiso   1.00
C1605  C     0.26660   0.67634  -0.57791   0.00000  Uiso   1.00
H1606  H     0.25861   0.68498  -0.55461   0.00000  Uiso   1.00
H1607  H     0.26916   0.68982  -0.58151   0.00000  Uiso   1.00
C1608  C     0.26424   0.66066  -0.57281   0.00000  Uiso   1.00
C1609  C     0.26183   0.65685  -0.58126   0.00000  Uiso   1.00
C1610  C     0.26266   0.64791  -0.58287   0.00000  Uiso   1.00
C1611  C     0.26606   0.64215  -0.57611   0.00000  Uiso   1.00
C1612  C     0.26854   0.64582  -0.56768   0.00000  Uiso   1.00
C1613  C     0.26755   0.65472  -0.56607   0.00000  Uiso   1.00
H1614  H     0.25859   0.66904  -0.55756   0.00000  Uiso   1.00
H1615  H     0.26900   0.67390  -0.58441   0.00000  Uiso   1.00
H1616  H     0.25924   0.66118  -0.58659   0.00000  Uiso   1.00
H1617  H     0.26070   0.64527  -0.58942   0.00000  Uiso   1.00
H1618  H     0.27118   0.64154  -0.56234   0.00000  Uiso   1.00
H1619  H     0.26960   0.65739  -0.55955   0.00000  Uiso   1.00
C1620  C     0.27720   0.72888  -0.59056   0.00000  Uiso   1.00
C1621  C     0.27666   0.71971  -0.59219   0.00000  Uiso   1.00
C1622  C     0.27348   0.71400  -0.58569   0.00000  Uiso   1.00
C1623  C     0.27064   0.71748  -0.57729   0.00000  Uiso   1.00
C1624  C     0.27119   0.72686  -0.57575   0.00000  Uiso   1.00
C1625  C     0.27448   0.73242  -0.58235   0.00000  Uiso   1.00
C1626  C     0.26741   0.71181  -0.57079   0.00000  Uiso   1.00
N1627  N     0.26467   0.71547  -0.56303   0.00000  Uiso   1.00
C1628  C     0.26158   0.70955  -0.55698   0.00000  Uiso   1.00
N1629  N     0.26118   0.70062  -0.55814   0.00000  Uiso   1.00
C1630  C     0.26411   0.69775  -0.56615   0.00000  Uiso   1.00
N1631  N     0.26724   0.70302  -0.57274   0.00000  Uiso   1.00
H1632  H     0.27314   0.70682  -0.58713   0.00000  Uiso   1.00
H1633  H     0.26908   0.72978  -0.56937   0.00000  Uiso   1.00
H1634  H     0.27874   0.71704  -0.59868   0.00000  Uiso   1.00
H1635  H     0.27495   0.73964  -0.58118   0.00000  Uiso   1.00
C1636  C     0.25198   0.71980  -0.53287   0.00000  Uiso   1.00
C1637  C     0.25537   0.72562  -0.53934   0.00000  Uiso   1.00
C1638  C     0.25864   0.72231  -0.54731   0.00000  Uiso   1.00
C1639  C     0.25853   0.71292  -0.54896   0.00000  Uiso   1.00
C1640  C     0.25509   0.70710  -0.54226   0.00000  Uiso   1.00
C1641  C     0.25186   0.71059  -0.53435   0.00000  Uiso   1.00
H1642  H     0.26122   0.72701  -0.55231   0.00000  Uiso   1.00
H1643  H     0.25488   0.69984  -0.54329   0.00000  Uiso   1.00
H1644  H     0.25542   0.73284  -0.53807   0.00000  Uiso   1.00
H1645  H     0.24918   0.70612  -0.52919   0.00000  Uiso   1.00
C1646  C     0.25620   0.60980  -0.61043   0.00000  Uiso   1.00
C1647  C     0.25972   0.60423  -0.60381   0.00000  Uiso   1.00
C1648  C     0.26274   0.60778  -0.59584   0.00000  Uiso   1.00
C1649  C     0.26226   0.61718  -0.59436   0.00000  Uiso   1.00
C1650  C     0.25866   0.62276  -0.60121   0.00000  Uiso   1.00
C1651  C     0.25568   0.61902  -0.60910   0.00000  Uiso   1.00
H1652  H     0.26548   0.60328  -0.59075   0.00000  Uiso   1.00
H1653  H     0.25816   0.63002  -0.60032   0.00000  Uiso   1.00
H1654  H     0.26012   0.59701  -0.60500   0.00000  Uiso   1.00
H1655  H     0.25290   0.62331  -0.61436   0.00000  Uiso   1.00
C1656  C     0.26687   0.63307  -0.57759   0.00000  Uiso   1.00
N1657  N     0.27021   0.62817  -0.57085   0.00000  Uiso   1.00
C1658  C     0.27085   0.61934  -0.57247   0.00000  Uiso   1.00
N1659  N     0.26837   0.61527  -0.58011   0.00000  Uiso   1.00
C1660  C     0.26508   0.62086  -0.58640   0.00000  Uiso   1.00
N1661  N     0.26422   0.62980  -0.58553   0.00000  Uiso   1.00
C1662  C     0.28268   0.60430  -0.55186   0.00000  Uiso   1.00
C1663  C     0.28103   0.61364  -0.55095   0.00000  Uiso   1.00
C1664  C     0.27710   0.61847  -0.55759   0.00000  Uiso   1.00
C1665  C     0.27436   0.61421  -0.56565   0.00000  Uiso   1.00
C1666  C     0.27554   0.60482  -0.56653   0.00000  Uiso   1.00
C1667  C     0.27948   0.60005  -0.55981   0.00000  Uiso   1.00
H1668  H     0.27624   0.62569  -0.55663   0.00000  Uiso   1.00
H1669  H     0.27344   0.60134  -0.57263   0.00000  Uiso   1.00
H1670  H     0.28321   0.61724  -0.54493   0.00000  Uiso   1.00
H1671  H     0.28062   0.59288  -0.56083   0.00000  Uiso   1.00
H1672  H     0.27978   0.73335  -0.59577   0.00000  Uiso   1.00
H1673  H     0.24940   0.72250  -0.52656   0.00000  Uiso   1.00
H1674  H     0.25386   0.60692  -0.61675   0.00000  Uiso   1.00
C1675  C     0.19234   0.50762  -0.50367   0.00000  Uiso   1.00
C1676  C     0.19446   0.51510  -0.50920   0.00000  Uiso   1.00
C1677  C     0.18804   0.51962  -0.51383   0.00000  Uiso   1.00
C1678  C     0.17893   0.51694  -0.51320   0.00000  Uiso   1.00
C1679  C     0.17664   0.50958  -0.50762   0.00000  Uiso   1.00
C1680  C     0.18314   0.50510  -0.50304   0.00000  Uiso   1.00
H1681  H     0.19002   0.52528  -0.51804   0.00000  Uiso   1.00
H1682  H     0.16968   0.50735  -0.50700   0.00000  Uiso   1.00
C1683  C     0.19922   0.50276  -0.49902   0.00000  Uiso   1.00
C1684  C     0.19754   0.49844  -0.49066   0.00000  Uiso   1.00
C1685  C     0.20415   0.49406  -0.48614   0.00000  Uiso   1.00
C1686  C     0.21297   0.49374  -0.48969   0.00000  Uiso   1.00
C1687  C     0.21473   0.49786  -0.49809   0.00000  Uiso   1.00
C1688  C     0.20807   0.50220  -0.50255   0.00000  Uiso   1.00
H1689  H     0.20140   0.51740  -0.50981   0.00000  Uiso   1.00
H1690  H     0.18116   0.49935  -0.49894   0.00000  Uiso   1.00
H1691  H     0.19087   0.49875  -0.48763   0.00000  Uiso   1.00
H1692  H     0.20258   0.49094  -0.47969   0.00000  Uiso   1.00
H1693  H     0.22144   0.49771  -0.50103   0.00000  Uiso   1.00
H1694  H     0.20968   0.50528  -0.50901   0.00000  Uiso   1.00
C1695  C     0.13120   0.51540  -0.52015   0.00000  Uiso   1.00
C1696  C     0.13769   0.51085  -0.51521   0.00000  Uiso   1.00
C1697  C     0.14656   0.51334  -0.51577   0.00000  Uiso   1.00
C1698  C     0.14910   0.52057  -0.52142   0.00000  Uiso   1.00
C1699  C     0.14240   0.52514  -0.52641   0.00000  Uiso   1.00
C1700  C     0.13358   0.52251  -0.52571   0.00000  Uiso   1.00
C1701  C     0.15793   0.52314  -0.52204   0.00000  Uiso   1.00
N1702  N     0.15984   0.53004  -0.52751   0.00000  Uiso   1.00
C1703  C     0.16856   0.53226  -0.52784   0.00000  Uiso   1.00
N1704  N     0.17514   0.52819  -0.52325   0.00000  Uiso   1.00
C1705  C     0.17244   0.52138  -0.51802   0.00000  Uiso   1.00
N1706  N     0.16394   0.51854  -0.51715   0.00000  Uiso   1.00
H1707  H     0.15154   0.50967  -0.51183   0.00000  Uiso   1.00
H1708  H     0.14410   0.53073  -0.53082   0.00000  Uiso   1.00
H1709  H     0.13571   0.50528  -0.51087   0.00000  Uiso   1.00
H1710  H     0.12840   0.52602  -0.52954   0.00000  Uiso   1.00
C1711  C     0.17582   0.55332  -0.54463   0.00000  Uiso   1.00
C1712  C     0.16685   0.55080  -0.54400   0.00000  Uiso   1.00
C1713  C     0.16435   0.54386  -0.53845   0.00000  Uiso   1.00
C1714  C     0.17094   0.53925  -0.53335   0.00000  Uiso   1.00
C1715  C     0.18005   0.54194  -0.53406   0.00000  Uiso   1.00
C1716  C     0.18237   0.54890  -0.53966   0.00000  Uiso   1.00
H1717  H     0.15728   0.54197  -0.53808   0.00000  Uiso   1.00
H1718  H     0.18531   0.53855  -0.53023   0.00000  Uiso   1.00
H1719  H     0.16179   0.55435  -0.54794   0.00000  Uiso   1.00
H1720  H     0.18938   0.55096  -0.54023   0.00000  Uiso   1.00
C1721  C     0.22001   0.47076  -0.44783   0.00000  Uiso   1.00
C1722  C     0.22862   0.47060  -0.45142   0.00000  Uiso   1.00
C1723  C     0.23030   0.47432  -0.45969   0.00000  Uiso   1.00
C1724  C     0.22320   0.47837  -0.46459   0.00000  Uiso   1.00
C1725  C     0.21444   0.47843  -0.46085   0.00000  Uiso   1.00
C1726  C     0.21296   0.47466  -0.45255   0.00000  Uiso   1.00
H1727  H     0.23712   0.47414  -0.46237   0.00000  Uiso   1.00
H1728  H     0.20881   0.48149  -0.46441   0.00000  Uiso   1.00
H1729  H     0.23408   0.46750  -0.44763   0.00000  Uiso   1.00
H1730  H     0.20624   0.47474  -0.44963   0.00000  Uiso   1.00
C1731  C     0.21982   0.48970  -0.48500   0.00000  Uiso   1.00
N1732  N     0.22801   0.48992  -0.48872   0.00000  Uiso   1.00
C1733  C     0.23449   0.48603  -0.48383   0.00000  Uiso   1.00
N1734  N     0.23330   0.48207  -0.47584   0.00000  Uiso   1.00
C1735  C     0.22482   0.48225  -0.47279   0.00000  Uiso   1.00
N1736  N     0.21781   0.48598  -0.47705   0.00000  Uiso   1.00
C1737  C     0.26072   0.48835  -0.49371   0.00000  Uiso   1.00
C1738  C     0.25322   0.49160  -0.49865   0.00000  Uiso   1.00
C1739  C     0.24469   0.49067  -0.49557   0.00000  Uiso   1.00
C1740  C     0.24306   0.48630  -0.48727   0.00000  Uiso   1.00
C1741  C     0.25040   0.48266  -0.48242   0.00000  Uiso   1.00
C1742  C     0.25891   0.48360  -0.48559   0.00000  Uiso   1.00
H1743  H     0.23919   0.49354  -0.49947   0.00000  Uiso   1.00
H1744  H     0.24934   0.47926  -0.47601   0.00000  Uiso   1.00
H1745  H     0.25428   0.49525  -0.50493   0.00000  Uiso   1.00
H1746  H     0.26448   0.48110  -0.48151   0.00000  Uiso   1.00
H1747  H     0.12418   0.51338  -0.51965   0.00000  Uiso   1.00
H1748  H     0.17774   0.55884  -0.54906   0.00000  Uiso   1.00
H1749  H     0.21876   0.46780  -0.44125   0.00000  Uiso   1.00
C1750  C     0.40506   0.44696  -0.48189   0.00000  Uiso   1.00
C1751  C     0.40928   0.45457  -0.47793   0.00000  Uiso   1.00
C1752  C     0.41664   0.45371  -0.47258   0.00000  Uiso   1.00
C1753  C     0.42026   0.44510  -0.47077   0.00000  Uiso   1.00
C1754  C     0.41607   0.43743  -0.47455   0.00000  Uiso   1.00
C1755  C     0.40876   0.43836  -0.47991   0.00000  Uiso   1.00
H1756  H     0.41974   0.45974  -0.46980   0.00000  Uiso   1.00
H1757  H     0.41867   0.43070  -0.47327   0.00000  Uiso   1.00
C1758  C     0.39754   0.44785  -0.48777   0.00000  Uiso   1.00
C1759  C     0.39656   0.44215  -0.49539   0.00000  Uiso   1.00
C1760  C     0.38928   0.44268  -0.50084   0.00000  Uiso   1.00
C1761  C     0.38234   0.44893  -0.49899   0.00000  Uiso   1.00
C1762  C     0.38326   0.45480  -0.49155   0.00000  Uiso   1.00
C1763  C     0.39062   0.45428  -0.48617   0.00000  Uiso   1.00
H1764  H     0.40672   0.46130  -0.47935   0.00000  Uiso   1.00
H1765  H     0.40568   0.43232  -0.48271   0.00000  Uiso   1.00
H1766  H     0.40175   0.43720  -0.49694   0.00000  Uiso   1.00
H1767  H     0.38881   0.43809  -0.50654   0.00000  Uiso   1.00
H1768  H     0.37803   0.45969  -0.48996   0.00000  Uiso   1.00
H1769  H     0.39108   0.45874  -0.48037   0.00000  Uiso   1.00
C1770  C     0.44854   0.40961  -0.45464   0.00000  Uiso   1.00
C1771  C     0.44091   0.41066  -0.45991   0.00000  Uiso   1.00
C1772  C     0.43748   0.41908  -0.46152   0.00000  Uiso   1.00
C1773  C     0.44174   0.42672  -0.45778   0.00000  Uiso   1.00
C1774  C     0.44953   0.42554  -0.45243   0.00000  Uiso   1.00
C1775  C     0.45281   0.41704  -0.45093   0.00000  Uiso   1.00
C1776  C     0.43832   0.43516  -0.45927   0.00000  Uiso   1.00
N1777  N     0.44264   0.44211  -0.45553   0.00000  Uiso   1.00
C1778  C     0.43894   0.45016  -0.45717   0.00000  Uiso   1.00
N1779  N     0.43154   0.45159  -0.46213   0.00000  Uiso   1.00
C1780  C     0.42782   0.44414  -0.46555   0.00000  Uiso   1.00
N1781  N     0.43090   0.43576  -0.46433   0.00000  Uiso   1.00
H1782  H     0.43147   0.41973  -0.46567   0.00000  Uiso   1.00
H1783  H     0.45299   0.43126  -0.44944   0.00000  Uiso   1.00
H1784  H     0.43764   0.40476  -0.46278   0.00000  Uiso   1.00
H1785  H     0.45880   0.41609  -0.44680   0.00000  Uiso   1.00
C1786  C     0.45122   0.47244  -0.44570   0.00000  Uiso   1.00
C1787  C     0.45492   0.46396  -0.44443   0.00000  Uiso   1.00
C1788  C     0.45093   0.45653  -0.44819   0.00000  Uiso   1.00
C1789  C     0.44304   0.45752  -0.45343   0.00000  Uiso   1.00
C1790  C     0.43939   0.46622  -0.45469   0.00000  Uiso   1.00
C1791  C     0.44346   0.47352  -0.45078   0.00000  Uiso   1.00
H1792  H     0.45394   0.44994  -0.44707   0.00000  Uiso   1.00
H1793  H     0.43332   0.46721  -0.45866   0.00000  Uiso   1.00
H1794  H     0.46102   0.46322  -0.44043   0.00000  Uiso   1.00
H1795  H     0.44064   0.48022  -0.45167   0.00000  Uiso   1.00
C1796  C     0.36514   0.42596  -0.53764   0.00000  Uiso   1.00
C1797  C     0.35802   0.43170  -0.53575   0.00000  Uiso   1.00
C1798  C     0.35846   0.43744  -0.52854   0.00000  Uiso   1.00
C1799  C     0.36623   0.43754  -0.52303   0.00000  Uiso   1.00
C1800  C     0.37342   0.43164  -0.52506   0.00000  Uiso   1.00
C1801  C     0.37280   0.42596  -0.53230   0.00000  Uiso   1.00
H1802  H     0.35280   0.44191  -0.52721   0.00000  Uiso   1.00
H1803  H     0.37951   0.43155  -0.52098   0.00000  Uiso   1.00
H1804  H     0.35207   0.43162  -0.54003   0.00000  Uiso   1.00
H1805  H     0.37834   0.42142  -0.53387   0.00000  Uiso   1.00
C1806  C     0.37472   0.44903  -0.50422   0.00000  Uiso   1.00
N1807  N     0.36820   0.45488  -0.50209   0.00000  Uiso   1.00
C1808  C     0.36088   0.45439  -0.50734   0.00000  Uiso   1.00
N1809  N     0.35982   0.44875  -0.51430   0.00000  Uiso   1.00
C1810  C     0.36684   0.44334  -0.51588   0.00000  Uiso   1.00
N1811  N     0.37442   0.44314  -0.51103   0.00000  Uiso   1.00
C1812  C     0.33962   0.47218  -0.50238   0.00000  Uiso   1.00
C1813  C     0.34773   0.47256  -0.49721   0.00000  Uiso   1.00
C1814  C     0.35455   0.46666  -0.49865   0.00000  Uiso   1.00
C1815  C     0.35386   0.46012  -0.50554   0.00000  Uiso   1.00
C1816  C     0.34589   0.45962  -0.51073   0.00000  Uiso   1.00
C1817  C     0.33899   0.46534  -0.50912   0.00000  Uiso   1.00
H1818  H     0.36062   0.46719  -0.49457   0.00000  Uiso   1.00
H1819  H     0.34516   0.45462  -0.51604   0.00000  Uiso   1.00
H1820  H     0.34845   0.47770  -0.49203   0.00000  Uiso   1.00
H1821  H     0.33293   0.46490  -0.51325   0.00000  Uiso   1.00
H1822  H     0.45120   0.40289  -0.45340   0.00000  Uiso   1.00
H1823  H     0.45440   0.47829  -0.44266   0.00000  Uiso   1.00
H1824  H     0.36472   0.42142  -0.54338   0.00000  Uiso   1.00
C1825  C     0.33868   0.45346  -0.34031   0.00000  Uiso   1.00
C1826  C     0.34668   0.44884  -0.33783   0.00000  Uiso   1.00
C1827  C     0.35487   0.45282  -0.33842   0.00000  Uiso   1.00
C1828  C     0.35563   0.46174  -0.34165   0.00000  Uiso   1.00
C1829  C     0.34776   0.46642  -0.34423   0.00000  Uiso   1.00
C1830  C     0.33960   0.46242  -0.34354   0.00000  Uiso   1.00
H1831  H     0.36081   0.44903  -0.33638   0.00000  Uiso   1.00
H1832  H     0.34813   0.47330  -0.34677   0.00000  Uiso   1.00
C1833  C     0.33009   0.44928  -0.33957   0.00000  Uiso   1.00
C1834  C     0.32233   0.45429  -0.33707   0.00000  Uiso   1.00
C1835  C     0.31414   0.45035  -0.33634   0.00000  Uiso   1.00
C1836  C     0.31312   0.44107  -0.33819   0.00000  Uiso   1.00
C1837  C     0.32075   0.43596  -0.34069   0.00000  Uiso   1.00
C1838  C     0.32892   0.43995  -0.34131   0.00000  Uiso   1.00
H1839  H     0.34630   0.44199  -0.33523   0.00000  Uiso   1.00
H1840  H     0.33366   0.46618  -0.34562   0.00000  Uiso   1.00
H1841  H     0.32292   0.46145  -0.33557   0.00000  Uiso   1.00
H1842  H     0.30839   0.45446  -0.33439   0.00000  Uiso   1.00
H1843  H     0.32018   0.42880  -0.34216   0.00000  Uiso   1.00
H1844  H     0.33468   0.43586  -0.34332   0.00000  Uiso   1.00
C1845  C     0.37416   0.50385  -0.35589   0.00000  Uiso   1.00
C1846  C     0.36582   0.49970  -0.35526   0.00000  Uiso   1.00
C1847  C     0.36512   0.49112  -0.35193   0.00000  Uiso   1.00
C1848  C     0.37296   0.48646  -0.34915   0.00000  Uiso   1.00
C1849  C     0.38141   0.49079  -0.34985   0.00000  Uiso   1.00
C1850  C     0.38190   0.49939  -0.35319   0.00000  Uiso   1.00
C1851  C     0.37234   0.47786  -0.34590   0.00000  Uiso   1.00
N1852  N     0.37998   0.47378  -0.34346   0.00000  Uiso   1.00
C1853  C     0.37893   0.46538  -0.34039   0.00000  Uiso   1.00
N1854  N     0.37107   0.46104  -0.33965   0.00000  Uiso   1.00
C1855  C     0.36389   0.46580  -0.34227   0.00000  Uiso   1.00
N1856  N     0.36411   0.47422  -0.34545   0.00000  Uiso   1.00
H1857  H     0.35850   0.48801  -0.35150   0.00000  Uiso   1.00
H1858  H     0.38758   0.48742  -0.34779   0.00000  Uiso   1.00
H1859  H     0.35981   0.50326  -0.35743   0.00000  Uiso   1.00
H1860  H     0.38840   0.50274  -0.35374   0.00000  Uiso   1.00
C1861  C     0.40187   0.45162  -0.33245   0.00000  Uiso   1.00
C1862  C     0.40260   0.46035  -0.33569   0.00000  Uiso   1.00
C1863  C     0.39508   0.46498  -0.33835   0.00000  Uiso   1.00
C1864  C     0.38652   0.46084  -0.33778   0.00000  Uiso   1.00
C1865  C     0.38590   0.45193  -0.33447   0.00000  Uiso   1.00
C1866  C     0.39354   0.44746  -0.33185   0.00000  Uiso   1.00
H1867  H     0.39582   0.47182  -0.34087   0.00000  Uiso   1.00
H1868  H     0.37943   0.44852  -0.33393   0.00000  Uiso   1.00
H1869  H     0.40920   0.46352  -0.33611   0.00000  Uiso   1.00
H1870  H     0.39308   0.44060  -0.32930   0.00000  Uiso   1.00
C1871  C     0.26776   0.45323  -0.32725   0.00000  Uiso   1.00
C1872  C     0.26670   0.44418  -0.32926   0.00000  Uiso   1.00
C1873  C     0.27398   0.43909  -0.33179   0.00000  Uiso   1.00
C1874  C     0.28260   0.44310  -0.33235   0.00000  Uiso   1.00
C1875  C     0.28355   0.45234  -0.33027   0.00000  Uiso   1.00
C1876  C     0.27616   0.45727  -0.32776   0.00000  Uiso   1.00
H1877  H     0.27299   0.43199  -0.33334   0.00000  Uiso   1.00
H1878  H     0.29008   0.45565  -0.33062   0.00000  Uiso   1.00
H1879  H     0.26006   0.44110  -0.32882   0.00000  Uiso   1.00
H1880  H     0.27687   0.46438  -0.32615   0.00000  Uiso   1.00
C1881  C     0.30480   0.43709  -0.33766   0.00000  Uiso   1.00
N1882  N     0.30425   0.42833  -0.33968   0.00000  Uiso   1.00
C1883  C     0.29596   0.42485  -0.33913   0.00000  Uiso   1.00
N1884  N     0.28856   0.42940  -0.33674   0.00000  Uiso   1.00
C1885  C     0.28993   0.43810  -0.33485   0.00000  Uiso   1.00
N1886  N     0.29788   0.44231  -0.33522   0.00000  Uiso   1.00
C1887  C     0.29277   0.39780  -0.34620   0.00000  Uiso   1.00
C1888  C     0.30136   0.40199  -0.34631   0.00000  Uiso   1.00
C1889  C     0.30245   0.41072  -0.34393   0.00000  Uiso   1.00
C1890  C     0.29495   0.41592  -0.34125   0.00000  Uiso   1.00
C1891  C     0.28635   0.41185  -0.34098   0.00000  Uiso   1.00
C1892  C     0.28534   0.40311  -0.34337   0.00000  Uiso   1.00
H1893  H     0.30916   0.41366  -0.34419   0.00000  Uiso   1.00
H1894  H     0.28043   0.41568  -0.33896   0.00000  Uiso   1.00
H1895  H     0.30728   0.39817  -0.34835   0.00000  Uiso   1.00
H1896  H     0.27859   0.40024  -0.34329   0.00000  Uiso   1.00
H1897  H     0.37462   0.51066  -0.35854   0.00000  Uiso   1.00
H1898  H     0.40789   0.44801  -0.33035   0.00000  Uiso   1.00
H1899  H     0.26194   0.45720  -0.32524   0.00000  Uiso   1.00
C1900  C     0.21304   0.50597  -0.37765   0.00000  Uiso   1.00
C1901  C     0.21491   0.51306  -0.37153   0.00000  Uiso   1.00
C1902  C     0.20920   0.52010  -0.37047   0.00000  Uiso   1.00
C1903  C     0.20118   0.52057  -0.37555   0.00000  Uiso   1.00
C1904  C     0.19917   0.51356  -0.38168   0.00000  Uiso   1.00
C1905  C     0.20490   0.50653  -0.38264   0.00000  Uiso   1.00
H1906  H     0.21094   0.52538  -0.36568   0.00000  Uiso   1.00
H1907  H     0.19304   0.51372  -0.38570   0.00000  Uiso   1.00
C1908  C     0.21912   0.49862  -0.37882   0.00000  Uiso   1.00
C1909  C     0.21598   0.48981  -0.38078   0.00000  Uiso   1.00
C1910  C     0.22174   0.48283  -0.38195   0.00000  Uiso   1.00
C1911  C     0.23113   0.48420  -0.38129   0.00000  Uiso   1.00
C1912  C     0.23440   0.49293  -0.37935   0.00000  Uiso   1.00
C1913  C     0.22858   0.49984  -0.37814   0.00000  Uiso   1.00
H1914  H     0.22102   0.51288  -0.36748   0.00000  Uiso   1.00
H1915  H     0.20321   0.50130  -0.38750   0.00000  Uiso   1.00
H1916  H     0.20878   0.48852  -0.38129   0.00000  Uiso   1.00
H1917  H     0.21900   0.47619  -0.38342   0.00000  Uiso   1.00
H1918  H     0.24160   0.49421  -0.37881   0.00000  Uiso   1.00
H1919  H     0.23133   0.50651  -0.37675   0.00000  Uiso   1.00
C1920  C     0.15938   0.53621  -0.39381   0.00000  Uiso   1.00
C1921  C     0.16514   0.52892  -0.39471   0.00000  Uiso   1.00
C1922  C     0.17285   0.52842  -0.38966   0.00000  Uiso   1.00
C1923  C     0.17495   0.53538  -0.38350   0.00000  Uiso   1.00
C1924  C     0.16899   0.54276  -0.38266   0.00000  Uiso   1.00
C1925  C     0.16132   0.54308  -0.38780   0.00000  Uiso   1.00
C1926  C     0.18266   0.53496  -0.37846   0.00000  Uiso   1.00
N1927  N     0.18426   0.54174  -0.37276   0.00000  Uiso   1.00
C1928  C     0.19190   0.54096  -0.36805   0.00000  Uiso   1.00
N1929  N     0.19774   0.53413  -0.36869   0.00000  Uiso   1.00
C1930  C     0.19543   0.52774  -0.37459   0.00000  Uiso   1.00
N1931  N     0.18798   0.52778  -0.37966   0.00000  Uiso   1.00
H1932  H     0.17727   0.52264  -0.39049   0.00000  Uiso   1.00
H1933  H     0.17037   0.54824  -0.37800   0.00000  Uiso   1.00
H1934  H     0.16352   0.52357  -0.39946   0.00000  Uiso   1.00
H1935  H     0.15672   0.54876  -0.38718   0.00000  Uiso   1.00
C1936  C     0.19802   0.56130  -0.34996   0.00000  Uiso   1.00
C1937  C     0.19016   0.56180  -0.35499   0.00000  Uiso   1.00
C1938  C     0.18806   0.55514  -0.36101   0.00000  Uiso   1.00
C1939  C     0.19391   0.54770  -0.36209   0.00000  Uiso   1.00
C1940  C     0.20189   0.54730  -0.35691   0.00000  Uiso   1.00
C1941  C     0.20384   0.55407  -0.35094   0.00000  Uiso   1.00
H1942  H     0.18186   0.55567  -0.36488   0.00000  Uiso   1.00
H1943  H     0.20656   0.54170  -0.35756   0.00000  Uiso   1.00
H1944  H     0.18567   0.56753  -0.35413   0.00000  Uiso   1.00
H1945  H     0.20998   0.55378  -0.34694   0.00000  Uiso   1.00
C1946  C     0.22961   0.43698  -0.39091   0.00000  Uiso   1.00
C1947  C     0.23883   0.43835  -0.39043   0.00000  Uiso   1.00
C1948  C     0.24220   0.44676  -0.38867   0.00000  Uiso   1.00
C1949  C     0.23624   0.45408  -0.38735   0.00000  Uiso   1.00
C1950  C     0.22686   0.45255  -0.38788   0.00000  Uiso   1.00
C1951  C     0.22367   0.44407  -0.38964   0.00000  Uiso   1.00
H1952  H     0.24947   0.44768  -0.38831   0.00000  Uiso   1.00
H1953  H     0.22207   0.45801  -0.38689   0.00000  Uiso   1.00
H1954  H     0.24340   0.43270  -0.39144   0.00000  Uiso   1.00
H1955  H     0.21645   0.44288  -0.39005   0.00000  Uiso   1.00
C1956  C     0.23700   0.47718  -0.38255   0.00000  Uiso   1.00
N1957  N     0.24580   0.47896  -0.38192   0.00000  Uiso   1.00
C1958  C     0.25119   0.47188  -0.38326   0.00000  Uiso   1.00
N1959  N     0.24844   0.46350  -0.38509   0.00000  Uiso   1.00
C1960  C     0.23949   0.46251  -0.38553   0.00000  Uiso   1.00
N1961  N     0.23345   0.46909  -0.38435   0.00000  Uiso   1.00
C1962  C     0.27891   0.47647  -0.38189   0.00000  Uiso   1.00
C1963  C     0.27262   0.48351  -0.38042   0.00000  Uiso   1.00
C1964  C     0.26363   0.48204  -0.38084   0.00000  Uiso   1.00
C1965  C     0.26029   0.47334  -0.38274   0.00000  Uiso   1.00
C1966  C     0.26644   0.46622  -0.38416   0.00000  Uiso   1.00
C1967  C     0.27542   0.46777  -0.38377   0.00000  Uiso   1.00
H1968  H     0.25906   0.48767  -0.37972   0.00000  Uiso   1.00
H1969  H     0.26408   0.45943  -0.38563   0.00000  Uiso   1.00
H1970  H     0.27497   0.49033  -0.37907   0.00000  Uiso   1.00
H1971  H     0.28000   0.46214  -0.38485   0.00000  Uiso   1.00
H1972  H     0.15328   0.53654  -0.39786   0.00000  Uiso   1.00
H1973  H     0.19962   0.56664  -0.34519   0.00000  Uiso   1.00
H1974  H     0.22700   0.43027  -0.39230   0.00000  Uiso   1.00
C1975  C     0.43761   0.58588  -0.27105   0.00000  Uiso   1.00
C1976  C     0.43631   0.59479  -0.27425   0.00000  Uiso   1.00
C1977  C     0.43891   0.60205  -0.26939   0.00000  Uiso   1.00
C1978  C     0.44301   0.60088  -0.26088   0.00000  Uiso   1.00
C1979  C     0.44436   0.59207  -0.25756   0.00000  Uiso   1.00
C1980  C     0.44176   0.58486  -0.26250   0.00000  Uiso   1.00
H1981  H     0.43778   0.60876  -0.27213   0.00000  Uiso   1.00
H1982  H     0.44747   0.59095  -0.25101   0.00000  Uiso   1.00
C1983  C     0.43470   0.57826  -0.27612   0.00000  Uiso   1.00
C1984  C     0.43938   0.56994  -0.27570   0.00000  Uiso   1.00
C1985  C     0.43642   0.56257  -0.28017   0.00000  Uiso   1.00
C1986  C     0.42849   0.56302  -0.28542   0.00000  Uiso   1.00
C1987  C     0.42382   0.57129  -0.28607   0.00000  Uiso   1.00
C1988  C     0.42686   0.57862  -0.28157   0.00000  Uiso   1.00
H1989  H     0.43321   0.59592  -0.28081   0.00000  Uiso   1.00
H1990  H     0.44278   0.57816  -0.25968   0.00000  Uiso   1.00
H1991  H     0.44549   0.56936  -0.27168   0.00000  Uiso   1.00
H1992  H     0.44018   0.55630  -0.27955   0.00000  Uiso   1.00
H1993  H     0.41768   0.57184  -0.29003   0.00000  Uiso   1.00
H1994  H     0.42298   0.58484  -0.28203   0.00000  Uiso   1.00
C1995  C     0.46372   0.61016  -0.21836   0.00000  Uiso   1.00
C1996  C     0.46116   0.60276  -0.22344   0.00000  Uiso   1.00
C1997  C     0.45722   0.60392  -0.23171   0.00000  Uiso   1.00
C1998  C     0.45578   0.61271  -0.23508   0.00000  Uiso   1.00
C1999  C     0.45844   0.62018  -0.22981   0.00000  Uiso   1.00
C2000  C     0.46236   0.61883  -0.22156   0.00000  Uiso   1.00
C2001  C     0.45184   0.61396  -0.24331   0.00000  Uiso   1.00
N2002  N     0.45067   0.62244  -0.24612   0.00000  Uiso   1.00
C2003  C     0.44678   0.62322  -0.25421   0.00000  Uiso   1.00
N2004  N     0.44412   0.61635  -0.25939   0.00000  Uiso   1.00
C2005  C     0.44562   0.60820  -0.25589   0.00000  Uiso   1.00
N2006  N     0.44945   0.60658  -0.24791   0.00000  Uiso   1.00
H2007  H     0.45526   0.59801  -0.23557   0.00000  Uiso   1.00
H2008  H     0.45744   0.62705  -0.23219   0.00000  Uiso   1.00
H2009  H     0.46228   0.59600  -0.22083   0.00000  Uiso   1.00
H2010  H     0.46441   0.62457  -0.21749   0.00000  Uiso   1.00
C2011  C     0.44251   0.64899  -0.26398   0.00000  Uiso   1.00
C2012  C     0.44654   0.64782  -0.25563   0.00000  Uiso   1.00
C2013  C     0.44800   0.63934  -0.25232   0.00000  Uiso   1.00
C2014  C     0.44540   0.63174  -0.25743   0.00000  Uiso   1.00
C2015  C     0.44131   0.63306  -0.26593   0.00000  Uiso   1.00
C2016  C     0.43992   0.64162  -0.26909   0.00000  Uiso   1.00
H2017  H     0.45116   0.63858  -0.24575   0.00000  Uiso   1.00
H2018  H     0.43922   0.62737  -0.27005   0.00000  Uiso   1.00
H2019  H     0.44852   0.65369  -0.25171   0.00000  Uiso   1.00
H2020  H     0.43677   0.64265  -0.27563   0.00000  Uiso   1.00
C2021  C     0.44003   0.51646  -0.29019   0.00000  Uiso   1.00
C2022  C     0.43210   0.51681  -0.29510   0.00000  Uiso   1.00
C2023  C     0.42748   0.52476  -0.29592   0.00000  Uiso   1.00
C2024  C     0.43082   0.53264  -0.29175   0.00000  Uiso   1.00
C2025  C     0.43891   0.53215  -0.28675   0.00000  Uiso   1.00
C2026  C     0.44340   0.52412  -0.28604   0.00000  Uiso   1.00
H2027  H     0.42128   0.52487  -0.29983   0.00000  Uiso   1.00
H2028  H     0.44169   0.53808  -0.28345   0.00000  Uiso   1.00
H2029  H     0.42955   0.51074  -0.29831   0.00000  Uiso   1.00
H2030  H     0.44963   0.52372  -0.28220   0.00000  Uiso   1.00
C2031  C     0.42523   0.55546  -0.28961   0.00000  Uiso   1.00
N2032  N     0.41761   0.55629  -0.29435   0.00000  Uiso   1.00
C2033  C     0.41466   0.54864  -0.29806   0.00000  Uiso   1.00
N2034  N     0.41870   0.54062  -0.29739   0.00000  Uiso   1.00
C2035  C     0.42632   0.54064  -0.29259   0.00000  Uiso   1.00
N2036  N     0.42989   0.54784  -0.28852   0.00000  Uiso   1.00
C2037  C     0.39058   0.54967  -0.31270   0.00000  Uiso   1.00
C2038  C     0.39449   0.55753  -0.30896   0.00000  Uiso   1.00
C2039  C     0.40224   0.55726  -0.30417   0.00000  Uiso   1.00
C2040  C     0.40680   0.54901  -0.30291   0.00000  Uiso   1.00
C2041  C     0.40309   0.54110  -0.30667   0.00000  Uiso   1.00
C2042  C     0.39524   0.54146  -0.31129   0.00000  Uiso   1.00
H2043  H     0.40492   0.56350  -0.30139   0.00000  Uiso   1.00
H2044  H     0.40638   0.53461  -0.30579   0.00000  Uiso   1.00
H2045  H     0.39132   0.56408  -0.30988   0.00000  Uiso   1.00
H2046  H     0.39253   0.53514  -0.31385   0.00000  Uiso   1.00
H2047  H     0.46684   0.60916  -0.21181   0.00000  Uiso   1.00
H2048  H     0.44138   0.65576  -0.26655   0.00000  Uiso   1.00
H2049  H     0.44365   0.51012  -0.28959   0.00000  Uiso   1.00
C2050  C     0.31514   0.65661  -0.30926   0.00000  Uiso   1.00
C2051  C     0.31526   0.65530  -0.29979   0.00000  Uiso   1.00
C2052  C     0.31662   0.66224  -0.29403   0.00000  Uiso   1.00
C2053  C     0.31805   0.67103  -0.29739   0.00000  Uiso   1.00
C2054  C     0.31806   0.67246  -0.30680   0.00000  Uiso   1.00
C2055  C     0.31664   0.66548  -0.31249   0.00000  Uiso   1.00
H2056  H     0.31658   0.66093  -0.28682   0.00000  Uiso   1.00
H2057  H     0.31917   0.67914  -0.30959   0.00000  Uiso   1.00
C2058  C     0.31352   0.64934  -0.31530   0.00000  Uiso   1.00
C2059  C     0.30866   0.65066  -0.32343   0.00000  Uiso   1.00
C2060  C     0.30722   0.64382  -0.32929   0.00000  Uiso   1.00
C2061  C     0.31065   0.63513  -0.32745   0.00000  Uiso   1.00
C2062  C     0.31544   0.63366  -0.31936   0.00000  Uiso   1.00
C2063  C     0.31677   0.64052  -0.31351   0.00000  Uiso   1.00
H2064  H     0.31408   0.64861  -0.29701   0.00000  Uiso   1.00
H2065  H     0.31673   0.66679  -0.31971   0.00000  Uiso   1.00
H2066  H     0.30594   0.65728  -0.32503   0.00000  Uiso   1.00
H2067  H     0.30349   0.64518  -0.33545   0.00000  Uiso   1.00
H2068  H     0.31816   0.62704  -0.31776   0.00000  Uiso   1.00
H2069  H     0.32060   0.63922  -0.30739   0.00000  Uiso   1.00
C2070  C     0.32624   0.71848  -0.29951   0.00000  Uiso   1.00
C2071  C     0.32490   0.71134  -0.30537   0.00000  Uiso   1.00
C2072  C     0.32348   0.70283  -0.30208   0.00000  Uiso   1.00
C2073  C     0.32338   0.70133  -0.29267   0.00000  Uiso   1.00
C2074  C     0.32477   0.70870  -0.28680   0.00000  Uiso   1.00
C2075  C     0.32618   0.71714  -0.29027   0.00000  Uiso   1.00
C2076  C     0.32196   0.69287  -0.28931   0.00000  Uiso   1.00
N2077  N     0.32194   0.69191  -0.28036   0.00000  Uiso   1.00
C2078  C     0.32054   0.68349  -0.27749   0.00000  Uiso   1.00
N2079  N     0.31923   0.67632  -0.28279   0.00000  Uiso   1.00
C2080  C     0.31938   0.67810  -0.29161   0.00000  Uiso   1.00
N2081  N     0.32070   0.68622  -0.29527   0.00000  Uiso   1.00
H2082  H     0.32245   0.69732  -0.30681   0.00000  Uiso   1.00
H2083  H     0.32474   0.70780  -0.27953   0.00000  Uiso   1.00
H2084  H     0.32498   0.71251  -0.31260   0.00000  Uiso   1.00
H2085  H     0.32724   0.72282  -0.28577   0.00000  Uiso   1.00
C2086  C     0.32011   0.67928  -0.24991   0.00000  Uiso   1.00
C2087  C     0.32154   0.68788  -0.25325   0.00000  Uiso   1.00
C2088  C     0.32173   0.68936  -0.26237   0.00000  Uiso   1.00
C2089  C     0.32044   0.68210  -0.26838   0.00000  Uiso   1.00
C2090  C     0.31901   0.67336  -0.26485   0.00000  Uiso   1.00
C2091  C     0.31886   0.67207  -0.25572   0.00000  Uiso   1.00
H2092  H     0.32286   0.69618  -0.26483   0.00000  Uiso   1.00
H2093  H     0.31800   0.66761  -0.26928   0.00000  Uiso   1.00
H2094  H     0.32251   0.69346  -0.24861   0.00000  Uiso   1.00
H2095  H     0.31775   0.66536  -0.25299   0.00000  Uiso   1.00
C2096  C     0.28993   0.62828  -0.37041   0.00000  Uiso   1.00
C2097  C     0.29341   0.61977  -0.36877   0.00000  Uiso   1.00
C2098  C     0.29804   0.61806  -0.36097   0.00000  Uiso   1.00
C2099  C     0.29929   0.62500  -0.35457   0.00000  Uiso   1.00
C2100  C     0.29569   0.63363  -0.35635   0.00000  Uiso   1.00
C2101  C     0.29108   0.63516  -0.36420   0.00000  Uiso   1.00
H2102  H     0.30072   0.61133  -0.35984   0.00000  Uiso   1.00
H2103  H     0.29652   0.63914  -0.35159   0.00000  Uiso   1.00
H2104  H     0.29245   0.61444  -0.37371   0.00000  Uiso   1.00
H2105  H     0.28831   0.64180  -0.36559   0.00000  Uiso   1.00
C2106  C     0.30944   0.62828  -0.33352   0.00000  Uiso   1.00
N2107  N     0.31298   0.62024  -0.33152   0.00000  Uiso   1.00
C2108  C     0.31165   0.61391  -0.33779   0.00000  Uiso   1.00
N2109  N     0.30719   0.61509  -0.34553   0.00000  Uiso   1.00
C2110  C     0.30392   0.62338  -0.34677   0.00000  Uiso   1.00
N2111  N     0.30486   0.63025  -0.34102   0.00000  Uiso   1.00
C2112  C     0.32337   0.58862  -0.33375   0.00000  Uiso   1.00
C2113  C     0.32403   0.59550  -0.32716   0.00000  Uiso   1.00
C2114  C     0.32016   0.60368  -0.32835   0.00000  Uiso   1.00
C2115  C     0.31524   0.60554  -0.33628   0.00000  Uiso   1.00
C2116  C     0.31430   0.59868  -0.34282   0.00000  Uiso   1.00
C2117  C     0.31823   0.59056  -0.34156   0.00000  Uiso   1.00
H2118  H     0.32100   0.60880  -0.32317   0.00000  Uiso   1.00
H2119  H     0.31057   0.59988  -0.34902   0.00000  Uiso   1.00
H2120  H     0.32784   0.59435  -0.32100   0.00000  Uiso   1.00
H2121  H     0.31762   0.58560  -0.34693   0.00000  Uiso   1.00
H2122  H     0.32736   0.72521  -0.30219   0.00000  Uiso   1.00
H2123  H     0.31997   0.67818  -0.24267   0.00000  Uiso   1.00
H2124  H     0.28626   0.62957  -0.37661   0.00000  Uiso   1.00
C2125  C     0.22659   0.26294  -0.32744   0.00000  Uiso   1.00
C2126  C     0.23128   0.25790  -0.33408   0.00000  Uiso   1.00
C2127  C     0.23217   0.24885  -0.33346   0.00000  Uiso   1.00
C2128  C     0.22845   0.24417  -0.32605   0.00000  Uiso   1.00
C2129  C     0.22374   0.24906  -0.31938   0.00000  Uiso   1.00
C2130  C     0.22283   0.25810  -0.32010   0.00000  Uiso   1.00
H2131  H     0.23583   0.24528  -0.33871   0.00000  Uiso   1.00
H2132  H     0.22080   0.24565  -0.31359   0.00000  Uiso   1.00
C2133  C     0.22578   0.27248  -0.32807   0.00000  Uiso   1.00
C2134  C     0.21792   0.27703  -0.32507   0.00000  Uiso   1.00
C2135  C     0.21713   0.28610  -0.32565   0.00000  Uiso   1.00
C2136  C     0.22425   0.29130  -0.32922   0.00000  Uiso   1.00
C2137  C     0.23215   0.28691  -0.33221   0.00000  Uiso   1.00
C2138  C     0.23283   0.27784  -0.33169   0.00000  Uiso   1.00
H2139  H     0.23420   0.26132  -0.33988   0.00000  Uiso   1.00
H2140  H     0.21926   0.26170  -0.31479   0.00000  Uiso   1.00
H2141  H     0.21230   0.27319  -0.32233   0.00000  Uiso   1.00
H2142  H     0.21096   0.28928  -0.32329   0.00000  Uiso   1.00
H2143  H     0.23776   0.29073  -0.33499   0.00000  Uiso   1.00
H2144  H     0.23904   0.27465  -0.33398   0.00000  Uiso   1.00
C2145  C     0.21649   0.20874  -0.29562   0.00000  Uiso   1.00
C2146  C     0.21538   0.21798  -0.29641   0.00000  Uiso   1.00
C2147  C     0.21883   0.22248  -0.30369   0.00000  Uiso   1.00
C2148  C     0.22355   0.21768  -0.31043   0.00000  Uiso   1.00
C2149  C     0.22462   0.20826  -0.30952   0.00000  Uiso   1.00
C2150  C     0.22110   0.20394  -0.30217   0.00000  Uiso   1.00
C2151  C     0.22706   0.22212  -0.31771   0.00000  Uiso   1.00
N2152  N     0.23145   0.21719  -0.32384   0.00000  Uiso   1.00
C2153  C     0.23476   0.22190  -0.33077   0.00000  Uiso   1.00
N2154  N     0.23398   0.23082  -0.33186   0.00000  Uiso   1.00
C2155  C     0.22944   0.23502  -0.32531   0.00000  Uiso   1.00
N2156  N     0.22584   0.23104  -0.31809   0.00000  Uiso   1.00
H2157  H     0.21788   0.22973  -0.30417   0.00000  Uiso   1.00
H2158  H     0.22821   0.20435  -0.31457   0.00000  Uiso   1.00
H2159  H     0.21174   0.22166  -0.29121   0.00000  Uiso   1.00
H2160  H     0.22192   0.19668  -0.30144   0.00000  Uiso   1.00
C2161  C     0.24852   0.20780  -0.35052   0.00000  Uiso   1.00
C2162  C     0.24496   0.20322  -0.34321   0.00000  Uiso   1.00
C2163  C     0.24040   0.20780  -0.33661   0.00000  Uiso   1.00
C2164  C     0.23931   0.21724  -0.33728   0.00000  Uiso   1.00
C2165  C     0.24299   0.22180  -0.34479   0.00000  Uiso   1.00
C2166  C     0.24752   0.21706  -0.35128   0.00000  Uiso   1.00
H2167  H     0.23766   0.20406  -0.33093   0.00000  Uiso   1.00
H2168  H     0.24229   0.22906  -0.34553   0.00000  Uiso   1.00
H2169  H     0.24581   0.19596  -0.34271   0.00000  Uiso   1.00
H2170  H     0.25036   0.22056  -0.35707   0.00000  Uiso   1.00
C2171  C     0.19219   0.32587  -0.31905   0.00000  Uiso   1.00
C2172  C     0.19923   0.33096  -0.32247   0.00000  Uiso   1.00
C2173  C     0.20699   0.32686  -0.32533   0.00000  Uiso   1.00
C2174  C     0.20782   0.31739  -0.32479   0.00000  Uiso   1.00
C2175  C     0.20056   0.31230  -0.32130   0.00000  Uiso   1.00
C2176  C     0.19288   0.31658  -0.31849   0.00000  Uiso   1.00
H2177  H     0.21242   0.33100  -0.32799   0.00000  Uiso   1.00
H2178  H     0.20095   0.30500  -0.32079   0.00000  Uiso   1.00
H2179  H     0.19857   0.33826  -0.32287   0.00000  Uiso   1.00
H2180  H     0.18729   0.31268  -0.31579   0.00000  Uiso   1.00
C2181  C     0.22352   0.30049  -0.32978   0.00000  Uiso   1.00
N2182  N     0.23055   0.30500  -0.33317   0.00000  Uiso   1.00
C2183  C     0.22948   0.31393  -0.33352   0.00000  Uiso   1.00
N2184  N     0.22214   0.31840  -0.33085   0.00000  Uiso   1.00
C2185  C     0.21554   0.31320  -0.32761   0.00000  Uiso   1.00
N2186  N     0.21586   0.30422  -0.32689   0.00000  Uiso   1.00
C2187  C     0.25091   0.32906  -0.34378   0.00000  Uiso   1.00
C2188  C     0.25137   0.31953  -0.34319   0.00000  Uiso   1.00
C2189  C     0.24445   0.31460  -0.33987   0.00000  Uiso   1.00
C2190  C     0.23650   0.31890  -0.33690   0.00000  Uiso   1.00
C2191  C     0.23589   0.32838  -0.33745   0.00000  Uiso   1.00
C2192  C     0.24287   0.33324  -0.34075   0.00000  Uiso   1.00
H2193  H     0.24514   0.30731  -0.33954   0.00000  Uiso   1.00
H2194  H     0.22986   0.33190  -0.33523   0.00000  Uiso   1.00
H2195  H     0.25743   0.31600  -0.34535   0.00000  Uiso   1.00
H2196  H     0.24214   0.34053  -0.34115   0.00000  Uiso   1.00
H2197  H     0.21372   0.20524  -0.28981   0.00000  Uiso   1.00
H2198  H     0.25213   0.20410  -0.35571   0.00000  Uiso   1.00
H2199  H     0.18606   0.32920  -0.31679   0.00000  Uiso   1.00
C2200  C     0.34710   0.21806  -0.38065   0.00000  Uiso   1.00
C2201  C     0.35099   0.22154  -0.37264   0.00000  Uiso   1.00
C2202  C     0.35066   0.21693  -0.36478   0.00000  Uiso   1.00
C2203  C     0.34632   0.20846  -0.36437   0.00000  Uiso   1.00
C2204  C     0.34233   0.20493  -0.37225   0.00000  Uiso   1.00
C2205  C     0.34275   0.20957  -0.38009   0.00000  Uiso   1.00
H2206  H     0.35380   0.21983  -0.35883   0.00000  Uiso   1.00
H2207  H     0.33892   0.19844  -0.37215   0.00000  Uiso   1.00
C2208  C     0.34756   0.22289  -0.38894   0.00000  Uiso   1.00
C2209  C     0.34838   0.21833  -0.39730   0.00000  Uiso   1.00
C2210  C     0.34873   0.22286  -0.40520   0.00000  Uiso   1.00
C2211  C     0.34820   0.23236  -0.40530   0.00000  Uiso   1.00
C2212  C     0.34742   0.23704  -0.39705   0.00000  Uiso   1.00
C2213  C     0.34715   0.23244  -0.38917   0.00000  Uiso   1.00
H2214  H     0.35447   0.22800  -0.37277   0.00000  Uiso   1.00
H2215  H     0.33957   0.20668  -0.38604   0.00000  Uiso   1.00
H2216  H     0.34883   0.21100  -0.39745   0.00000  Uiso   1.00
H2217  H     0.34935   0.21906  -0.41144   0.00000  Uiso   1.00
H2218  H     0.34699   0.24436  -0.39689   0.00000  Uiso   1.00
H2219  H     0.34644   0.23623  -0.38293   0.00000  Uiso   1.00
C2220  C     0.32894   0.16665  -0.34787   0.00000  Uiso   1.00
C2221  C     0.32921   0.17147  -0.35587   0.00000  Uiso   1.00
C2222  C     0.33344   0.17966  -0.35623   0.00000  Uiso   1.00
C2223  C     0.33756   0.18322  -0.34841   0.00000  Uiso   1.00
C2224  C     0.33722   0.17822  -0.34031   0.00000  Uiso   1.00
C2225  C     0.33294   0.17004  -0.34015   0.00000  Uiso   1.00
C2226  C     0.34180   0.19140  -0.34869   0.00000  Uiso   1.00
N2227  N     0.34555   0.19439  -0.34107   0.00000  Uiso   1.00
C2228  C     0.34958   0.20242  -0.34177   0.00000  Uiso   1.00
N2229  N     0.35003   0.20739  -0.34927   0.00000  Uiso   1.00
C2230  C     0.34605   0.20371  -0.35647   0.00000  Uiso   1.00
N2231  N     0.34184   0.19576  -0.35658   0.00000  Uiso   1.00
H2232  H     0.33357   0.18332  -0.36257   0.00000  Uiso   1.00
H2233  H     0.34031   0.18074  -0.33416   0.00000  Uiso   1.00
H2234  H     0.32604   0.16872  -0.36187   0.00000  Uiso   1.00
H2235  H     0.33266   0.16617  -0.33393   0.00000  Uiso   1.00
C2236  C     0.36176   0.21272  -0.31888   0.00000  Uiso   1.00
C2237  C     0.35748   0.20442  -0.31851   0.00000  Uiso   1.00
C2238  C     0.35340   0.20094  -0.32602   0.00000  Uiso   1.00
C2239  C     0.35357   0.20583  -0.33419   0.00000  Uiso   1.00
C2240  C     0.35796   0.21428  -0.33445   0.00000  Uiso   1.00
C2241  C     0.36198   0.21760  -0.32683   0.00000  Uiso   1.00
H2242  H     0.35009   0.19442  -0.32557   0.00000  Uiso   1.00
H2243  H     0.35822   0.21823  -0.34061   0.00000  Uiso   1.00
H2244  H     0.35738   0.20068  -0.31221   0.00000  Uiso   1.00
H2245  H     0.36536   0.22410  -0.32701   0.00000  Uiso   1.00
C2246  C     0.35129   0.22282  -0.45245   0.00000  Uiso   1.00
C2247  C     0.35068   0.23214  -0.45259   0.00000  Uiso   1.00
C2248  C     0.34998   0.23688  -0.44470   0.00000  Uiso   1.00
C2249  C     0.34987   0.23224  -0.43638   0.00000  Uiso   1.00
C2250  C     0.35051   0.22274  -0.43636   0.00000  Uiso   1.00
C2251  C     0.35120   0.21817  -0.44435   0.00000  Uiso   1.00
H2252  H     0.34950   0.24418  -0.44498   0.00000  Uiso   1.00
H2253  H     0.35044   0.21896  -0.43009   0.00000  Uiso   1.00
H2254  H     0.35076   0.23568  -0.45901   0.00000  Uiso   1.00
H2255  H     0.35168   0.21086  -0.44435   0.00000  Uiso   1.00
C2256  C     0.34834   0.23696  -0.41331   0.00000  Uiso   1.00
N2257  N     0.34767   0.24593  -0.41297   0.00000  Uiso   1.00
C2258  C     0.34777   0.25002  -0.42100   0.00000  Uiso   1.00
N2259  N     0.34850   0.24586  -0.42895   0.00000  Uiso   1.00
C2260  C     0.34914   0.23689  -0.42845   0.00000  Uiso   1.00
N2261  N     0.34908   0.23208  -0.42084   0.00000  Uiso   1.00
C2262  C     0.34430   0.27792  -0.42132   0.00000  Uiso   1.00
C2263  C     0.34470   0.27306  -0.41311   0.00000  Uiso   1.00
C2264  C     0.34598   0.26403  -0.41295   0.00000  Uiso   1.00
C2265  C     0.34695   0.25921  -0.42110   0.00000  Uiso   1.00
C2266  C     0.34681   0.26396  -0.42935   0.00000  Uiso   1.00
C2267  C     0.34555   0.27299  -0.42942   0.00000  Uiso   1.00
H2268  H     0.34608   0.26057  -0.40649   0.00000  Uiso   1.00
H2269  H     0.34754   0.26044  -0.43574   0.00000  Uiso   1.00
H2270  H     0.34388   0.27656  -0.40671   0.00000  Uiso   1.00
H2271  H     0.34520   0.27642  -0.43589   0.00000  Uiso   1.00
H2272  H     0.32556   0.16016  -0.34767   0.00000  Uiso   1.00
H2273  H     0.36498   0.21541  -0.31287   0.00000  Uiso   1.00
H2274  H     0.35185   0.21912  -0.45875   0.00000  Uiso   1.00
C2275  C     0.26960   0.30806  -0.57831   0.00000  Uiso   1.00
C2276  C     0.26863   0.30687  -0.56887   0.00000  Uiso   1.00
C2277  C     0.26080   0.30398  -0.56520   0.00000  Uiso   1.00
C2278  C     0.25331   0.30209  -0.57077   0.00000  Uiso   1.00
C2279  C     0.25412   0.30331  -0.58017   0.00000  Uiso   1.00
C2280  C     0.26198   0.30619  -0.58376   0.00000  Uiso   1.00
H2281  H     0.26040   0.30309  -0.55793   0.00000  Uiso   1.00
H2282  H     0.24846   0.30194  -0.58464   0.00000  Uiso   1.00
C2283  C     0.27793   0.31092  -0.58216   0.00000  Uiso   1.00
C2284  C     0.28069   0.30790  -0.59080   0.00000  Uiso   1.00
C2285  C     0.28860   0.31053  -0.59449   0.00000  Uiso   1.00
C2286  C     0.29436   0.31645  -0.58975   0.00000  Uiso   1.00
C2287  C     0.29174   0.31955  -0.58115   0.00000  Uiso   1.00
C2288  C     0.28382   0.31685  -0.57752   0.00000  Uiso   1.00
H2289  H     0.27432   0.30812  -0.56441   0.00000  Uiso   1.00
H2290  H     0.26236   0.30710  -0.59103   0.00000  Uiso   1.00
H2291  H     0.27646   0.30325  -0.59459   0.00000  Uiso   1.00
H2292  H     0.29042   0.30800  -0.60113   0.00000  Uiso   1.00
H2293  H     0.29602   0.32412  -0.57734   0.00000  Uiso   1.00
H2294  H     0.28196   0.31942  -0.57090   0.00000  Uiso   1.00
C2295  C     0.20940   0.28854  -0.58542   0.00000  Uiso   1.00
C2296  C     0.21736   0.29168  -0.58915   0.00000  Uiso   1.00
C2297  C     0.22458   0.29365  -0.58373   0.00000  Uiso   1.00
C2298  C     0.22390   0.29246  -0.57431   0.00000  Uiso   1.00
C2299  C     0.21572   0.28926  -0.57063   0.00000  Uiso   1.00
C2300  C     0.20861   0.28735  -0.57619   0.00000  Uiso   1.00
C2301  C     0.23108   0.29435  -0.56884   0.00000  Uiso   1.00
N2302  N     0.22998   0.29306  -0.55999   0.00000  Uiso   1.00
C2303  C     0.23721   0.29500  -0.55499   0.00000  Uiso   1.00
N2304  N     0.24509   0.29802  -0.55817   0.00000  Uiso   1.00
C2305  C     0.24540   0.29904  -0.56711   0.00000  Uiso   1.00
N2306  N     0.23862   0.29733  -0.57277   0.00000  Uiso   1.00
H2307  H     0.23076   0.29610  -0.58681   0.00000  Uiso   1.00
H2308  H     0.21494   0.28826  -0.56341   0.00000  Uiso   1.00
H2309  H     0.21787   0.29259  -0.59640   0.00000  Uiso   1.00
H2310  H     0.20231   0.28488  -0.57338   0.00000  Uiso   1.00
C2311  C     0.23507   0.29135  -0.52742   0.00000  Uiso   1.00
C2312  C     0.22778   0.28941  -0.53292   0.00000  Uiso   1.00
C2313  C     0.22838   0.29060  -0.54205   0.00000  Uiso   1.00
C2314  C     0.23650   0.29381  -0.54588   0.00000  Uiso   1.00
C2315  C     0.24386   0.29575  -0.54017   0.00000  Uiso   1.00
C2316  C     0.24306   0.29451  -0.53106   0.00000  Uiso   1.00
H2317  H     0.22257   0.28904  -0.54623   0.00000  Uiso   1.00
H2318  H     0.25020   0.29824  -0.54288   0.00000  Uiso   1.00
H2319  H     0.22154   0.28694  -0.52995   0.00000  Uiso   1.00
H2320  H     0.24872   0.29600  -0.52665   0.00000  Uiso   1.00
C2321  C     0.31942   0.30924  -0.63026   0.00000  Uiso   1.00
C2322  C     0.32515   0.31502  -0.62569   0.00000  Uiso   1.00
C2323  C     0.32286   0.31820  -0.61733   0.00000  Uiso   1.00
C2324  C     0.31462   0.31556  -0.61335   0.00000  Uiso   1.00
C2325  C     0.30887   0.30965  -0.61811   0.00000  Uiso   1.00
C2326  C     0.31132   0.30658  -0.62646   0.00000  Uiso   1.00
H2327  H     0.32746   0.32273  -0.61387   0.00000  Uiso   1.00
H2328  H     0.30248   0.30747  -0.61526   0.00000  Uiso   1.00
H2329  H     0.33149   0.31704  -0.62877   0.00000  Uiso   1.00
H2330  H     0.30690   0.30204  -0.63014   0.00000  Uiso   1.00
C2331  C     0.30238   0.31911  -0.59349   0.00000  Uiso   1.00
N2332  N     0.30758   0.32470  -0.58869   0.00000  Uiso   1.00
C2333  C     0.31529   0.32702  -0.59271   0.00000  Uiso   1.00
N2334  N     0.31798   0.32423  -0.60085   0.00000  Uiso   1.00
C2335  C     0.31224   0.31866  -0.60500   0.00000  Uiso   1.00
N2336  N     0.30436   0.31588  -0.60165   0.00000  Uiso   1.00
C2337  C     0.33251   0.34455  -0.57897   0.00000  Uiso   1.00
C2338  C     0.32426   0.34165  -0.57510   0.00000  Uiso   1.00
C2339  C     0.31864   0.33598  -0.57951   0.00000  Uiso   1.00
C2340  C     0.32094   0.33273  -0.58816   0.00000  Uiso   1.00
C2341  C     0.32917   0.33547  -0.59209   0.00000  Uiso   1.00
C2342  C     0.33472   0.34115  -0.58762   0.00000  Uiso   1.00
H2343  H     0.31235   0.33400  -0.57631   0.00000  Uiso   1.00
H2344  H     0.33116   0.33308  -0.59873   0.00000  Uiso   1.00
H2345  H     0.32222   0.34414  -0.56851   0.00000  Uiso   1.00
H2346  H     0.34102   0.34308  -0.59083   0.00000  Uiso   1.00
H2347  H     0.20372   0.28700  -0.58978   0.00000  Uiso   1.00
H2348  H     0.23451   0.29038  -0.52017   0.00000  Uiso   1.00
H2349  H     0.32130   0.30676  -0.63690   0.00000  Uiso   1.00
C2350  C     0.39338   0.36176  -0.45699   0.00000  Uiso   1.00
C2351  C     0.40212   0.36562  -0.45742   0.00000  Uiso   1.00
C2352  C     0.40738   0.36640  -0.45003   0.00000  Uiso   1.00
C2353  C     0.40421   0.36343  -0.44157   0.00000  Uiso   1.00
C2354  C     0.39547   0.35971  -0.44095   0.00000  Uiso   1.00
C2355  C     0.39026   0.35898  -0.44841   0.00000  Uiso   1.00
H2356  H     0.41409   0.36928  -0.45073   0.00000  Uiso   1.00
H2357  H     0.39282   0.35738  -0.43452   0.00000  Uiso   1.00
C2358  C     0.38831   0.36009  -0.46499   0.00000  Uiso   1.00
C2359  C     0.38272   0.35237  -0.46580   0.00000  Uiso   1.00
C2360  C     0.37910   0.34992  -0.47381   0.00000  Uiso   1.00
C2361  C     0.38082   0.35508  -0.48161   0.00000  Uiso   1.00
C2362  C     0.38590   0.36308  -0.48083   0.00000  Uiso   1.00
C2363  C     0.38944   0.36549  -0.47278   0.00000  Uiso   1.00
H2364  H     0.40493   0.36770  -0.46387   0.00000  Uiso   1.00
H2365  H     0.38360   0.35600  -0.44771   0.00000  Uiso   1.00
H2366  H     0.38173   0.34792  -0.46006   0.00000  Uiso   1.00
H2367  H     0.37520   0.34372  -0.47418   0.00000  Uiso   1.00
H2368  H     0.38730   0.36725  -0.48670   0.00000  Uiso   1.00
H2369  H     0.39358   0.37154  -0.47249   0.00000  Uiso   1.00
C2370  C     0.40264   0.35328  -0.39439   0.00000  Uiso   1.00
C2371  C     0.39723   0.35228  -0.40194   0.00000  Uiso   1.00
C2372  C     0.40019   0.35514  -0.41021   0.00000  Uiso   1.00
C2373  C     0.40880   0.35912  -0.41104   0.00000  Uiso   1.00
C2374  C     0.41425   0.36004  -0.40328   0.00000  Uiso   1.00
C2375  C     0.41111   0.35715  -0.39509   0.00000  Uiso   1.00
C2376  C     0.41182   0.36206  -0.41923   0.00000  Uiso   1.00
N2377  N     0.42007   0.36568  -0.41954   0.00000  Uiso   1.00
C2378  C     0.42267   0.36840  -0.42772   0.00000  Uiso   1.00
N2379  N     0.41773   0.36779  -0.43522   0.00000  Uiso   1.00
C2380  C     0.40958   0.36413  -0.43409   0.00000  Uiso   1.00
N2381  N     0.40627   0.36112  -0.42627   0.00000  Uiso   1.00
H2382  H     0.39582   0.35430  -0.41603   0.00000  Uiso   1.00
H2383  H     0.42091   0.36307  -0.40366   0.00000  Uiso   1.00
H2384  H     0.39060   0.34922  -0.40127   0.00000  Uiso   1.00
H2385  H     0.41527   0.35789  -0.38911   0.00000  Uiso   1.00
C2386  C     0.44787   0.38014  -0.43005   0.00000  Uiso   1.00
C2387  C     0.44492   0.37715  -0.42171   0.00000  Uiso   1.00
C2388  C     0.43663   0.37319  -0.42084   0.00000  Uiso   1.00
C2389  C     0.43104   0.37218  -0.42849   0.00000  Uiso   1.00
C2390  C     0.43418   0.37521  -0.43695   0.00000  Uiso   1.00
C2391  C     0.44251   0.37914  -0.43763   0.00000  Uiso   1.00
H2392  H     0.43444   0.37094  -0.41422   0.00000  Uiso   1.00
H2393  H     0.43008   0.37453  -0.44298   0.00000  Uiso   1.00
H2394  H     0.44922   0.37798  -0.41583   0.00000  Uiso   1.00
H2395  H     0.44492   0.38151  -0.44413   0.00000  Uiso   1.00
C2396  C     0.35693   0.31780  -0.50079   0.00000  Uiso   1.00
C2397  C     0.35932   0.32253  -0.50849   0.00000  Uiso   1.00
C2398  C     0.36402   0.33044  -0.50781   0.00000  Uiso   1.00
C2399  C     0.36648   0.33378  -0.49923   0.00000  Uiso   1.00
C2400  C     0.36398   0.32888  -0.49146   0.00000  Uiso   1.00
C2401  C     0.35926   0.32099  -0.49233   0.00000  Uiso   1.00
H2402  H     0.36583   0.33403  -0.51393   0.00000  Uiso   1.00
H2403  H     0.36575   0.33124  -0.48475   0.00000  Uiso   1.00
H2404  H     0.35744   0.31994  -0.51508   0.00000  Uiso   1.00
H2405  H     0.35732   0.31719  -0.48637   0.00000  Uiso   1.00
C2406  C     0.37814   0.35206  -0.48991   0.00000  Uiso   1.00
N2407  N     0.38059   0.35693  -0.49707   0.00000  Uiso   1.00
C2408  C     0.37805   0.35350  -0.50501   0.00000  Uiso   1.00
N2409  N     0.37338   0.34590  -0.50613   0.00000  Uiso   1.00
C2410  C     0.37125   0.34162  -0.49848   0.00000  Uiso   1.00
N2411  N     0.37348   0.34436  -0.49019   0.00000  Uiso   1.00
C2412  C     0.38642   0.36702  -0.52822   0.00000  Uiso   1.00
C2413  C     0.38836   0.37041  -0.51951   0.00000  Uiso   1.00
C2414  C     0.38558   0.36613  -0.51196   0.00000  Uiso   1.00
C2415  C     0.38051   0.35811  -0.51261   0.00000  Uiso   1.00
C2416  C     0.37822   0.35478  -0.52123   0.00000  Uiso   1.00
C2417  C     0.38106   0.35912  -0.52872   0.00000  Uiso   1.00
H2418  H     0.38740   0.36891  -0.50543   0.00000  Uiso   1.00
H2419  H     0.37428   0.34864  -0.52197   0.00000  Uiso   1.00
H2420  H     0.39232   0.37654  -0.51873   0.00000  Uiso   1.00
H2421  H     0.37942   0.35616  -0.53523   0.00000  Uiso   1.00
H2422  H     0.40022   0.35101  -0.38786   0.00000  Uiso   1.00
H2423  H     0.45446   0.38328  -0.43066   0.00000  Uiso   1.00
H2424  H     0.35319   0.31153  -0.50141   0.00000  Uiso   1.00
C2425  C     0.38616   0.41152  -0.67225   0.00000  Uiso   1.00
C2426  C     0.38966   0.41998  -0.66951   0.00000  Uiso   1.00
C2427  C     0.39286   0.42600  -0.67557   0.00000  Uiso   1.00
C2428  C     0.39280   0.42392  -0.68485   0.00000  Uiso   1.00
C2429  C     0.38933   0.41554  -0.68772   0.00000  Uiso   1.00
C2430  C     0.38611   0.40959  -0.68161   0.00000  Uiso   1.00
H2431  H     0.39549   0.43240  -0.67315   0.00000  Uiso   1.00
H2432  H     0.38921   0.41374  -0.69483   0.00000  Uiso   1.00
C2433  C     0.38290   0.40518  -0.66583   0.00000  Uiso   1.00
C2434  C     0.37564   0.39930  -0.66787   0.00000  Uiso   1.00
C2435  C     0.37260   0.39319  -0.66182   0.00000  Uiso   1.00
C2436  C     0.37668   0.39252  -0.65325   0.00000  Uiso   1.00
C2437  C     0.38390   0.39833  -0.65107   0.00000  Uiso   1.00
C2438  C     0.38686   0.40443  -0.65716   0.00000  Uiso   1.00
H2439  H     0.38976   0.42180  -0.66241   0.00000  Uiso   1.00
H2440  H     0.38359   0.40313  -0.68401   0.00000  Uiso   1.00
H2441  H     0.37233   0.39969  -0.67440   0.00000  Uiso   1.00
H2442  H     0.36702   0.38881  -0.66368   0.00000  Uiso   1.00
H2443  H     0.38720   0.39796  -0.64453   0.00000  Uiso   1.00
H2444  H     0.39252   0.40872  -0.65533   0.00000  Uiso   1.00
C2445  C     0.39926   0.42730  -0.73251   0.00000  Uiso   1.00
C2446  C     0.39584   0.42120  -0.72633   0.00000  Uiso   1.00
C2447  C     0.39582   0.42322  -0.71732   0.00000  Uiso   1.00
C2448  C     0.39929   0.43156  -0.71433   0.00000  Uiso   1.00
C2449  C     0.40277   0.43770  -0.72073   0.00000  Uiso   1.00
C2450  C     0.40272   0.43550  -0.72969   0.00000  Uiso   1.00
C2451  C     0.39930   0.43366  -0.70535   0.00000  Uiso   1.00
N2452  N     0.40267   0.44167  -0.70298   0.00000  Uiso   1.00
C2453  C     0.40252   0.44333  -0.69413   0.00000  Uiso   1.00
N2454  N     0.39934   0.43773  -0.68783   0.00000  Uiso   1.00
C2455  C     0.39613   0.42994  -0.69100   0.00000  Uiso   1.00
N2456  N     0.39593   0.42754  -0.69967   0.00000  Uiso   1.00
H2457  H     0.39309   0.41833  -0.71259   0.00000  Uiso   1.00
H2458  H     0.40552   0.44418  -0.71867   0.00000  Uiso   1.00
H2459  H     0.39316   0.41479  -0.72865   0.00000  Uiso   1.00
H2460  H     0.40539   0.44021  -0.73463   0.00000  Uiso   1.00
C2461  C     0.41264   0.46785  -0.68551   0.00000  Uiso   1.00
C2462  C     0.41264   0.46580  -0.69461   0.00000  Uiso   1.00
C2463  C     0.40933   0.45770  -0.69756   0.00000  Uiso   1.00
C2464  C     0.40589   0.45142  -0.69128   0.00000  Uiso   1.00
C2465  C     0.40595   0.45362  -0.68201   0.00000  Uiso   1.00
C2466  C     0.40930   0.46177  -0.67925   0.00000  Uiso   1.00
H2467  H     0.40939   0.45623  -0.70474   0.00000  Uiso   1.00
H2468  H     0.40336   0.44896  -0.67699   0.00000  Uiso   1.00
H2469  H     0.41528   0.47065  -0.69943   0.00000  Uiso   1.00
H2470  H     0.40936   0.46348  -0.67213   0.00000  Uiso   1.00
C2471  C     0.34336   0.35777  -0.64957   0.00000  Uiso   1.00
C2472  C     0.34756   0.35710  -0.64126   0.00000  Uiso   1.00
C2473  C     0.35458   0.36269  -0.63913   0.00000  Uiso   1.00
C2474  C     0.35756   0.36918  -0.64543   0.00000  Uiso   1.00
C2475  C     0.35322   0.36975  -0.65389   0.00000  Uiso   1.00
C2476  C     0.34621   0.36408  -0.65584   0.00000  Uiso   1.00
H2477  H     0.35776   0.36205  -0.63255   0.00000  Uiso   1.00
H2478  H     0.35532   0.37466  -0.65891   0.00000  Uiso   1.00
H2479  H     0.34524   0.35211  -0.63641   0.00000  Uiso   1.00
H2480  H     0.34284   0.36450  -0.66234   0.00000  Uiso   1.00
C2481  C     0.37376   0.38624  -0.64714   0.00000  Uiso   1.00
N2482  N     0.37800   0.38599  -0.63921   0.00000  Uiso   1.00
C2483  C     0.37499   0.37969  -0.63352   0.00000  Uiso   1.00
N2484  N     0.36829   0.37394  -0.63521   0.00000  Uiso   1.00
C2485  C     0.36451   0.37486  -0.64334   0.00000  Uiso   1.00
N2486  N     0.36697   0.38087  -0.64959   0.00000  Uiso   1.00
C2487  C     0.38792   0.37798  -0.60860   0.00000  Uiso   1.00
C2488  C     0.39037   0.38458  -0.61506   0.00000  Uiso   1.00
C2489  C     0.38620   0.38515  -0.62313   0.00000  Uiso   1.00
C2490  C     0.37917   0.37913  -0.62531   0.00000  Uiso   1.00
C2491  C     0.37656   0.37256  -0.61894   0.00000  Uiso   1.00
C2492  C     0.38083   0.37202  -0.61090   0.00000  Uiso   1.00
H2493  H     0.38834   0.39032  -0.62787   0.00000  Uiso   1.00
H2494  H     0.37116   0.36782  -0.62043   0.00000  Uiso   1.00
H2495  H     0.39564   0.38947  -0.61357   0.00000  Uiso   1.00
H2496  H     0.37872   0.36682  -0.60618   0.00000  Uiso   1.00
H2497  H     0.39925   0.42563  -0.73965   0.00000  Uiso   1.00
H2498  H     0.41527   0.47430  -0.68324   0.00000  Uiso   1.00
H2499  H     0.33778   0.35330  -0.65119   0.00000  Uiso   1.00
C2500  C     0.42109   0.54122  -0.60267   0.00000  Uiso   1.00
C2501  C     0.42521   0.54060  -0.61128   0.00000  Uiso   1.00
C2502  C     0.42574   0.54781  -0.61685   0.00000  Uiso   1.00
C2503  C     0.42210   0.55619  -0.61418   0.00000  Uiso   1.00
C2504  C     0.41790   0.55692  -0.60567   0.00000  Uiso   1.00
C2505  C     0.41744   0.54969  -0.60015   0.00000  Uiso   1.00
H2506  H     0.42902   0.54703  -0.62335   0.00000  Uiso   1.00
H2507  H     0.41501   0.56328  -0.60344   0.00000  Uiso   1.00
C2508  C     0.42070   0.53366  -0.59676   0.00000  Uiso   1.00
C2509  C     0.42132   0.53475  -0.58728   0.00000  Uiso   1.00
C2510  C     0.42095   0.52762  -0.58162   0.00000  Uiso   1.00
C2511  C     0.41986   0.51881  -0.58507   0.00000  Uiso   1.00
C2512  C     0.41924   0.51758  -0.59448   0.00000  Uiso   1.00
C2513  C     0.41968   0.52476  -0.60009   0.00000  Uiso   1.00
H2514  H     0.42818   0.53426  -0.61347   0.00000  Uiso   1.00
H2515  H     0.41412   0.55046  -0.59365   0.00000  Uiso   1.00
H2516  H     0.42222   0.54145  -0.58441   0.00000  Uiso   1.00
H2517  H     0.42148   0.52880  -0.57440   0.00000  Uiso   1.00
H2518  H     0.41840   0.51088  -0.59735   0.00000  Uiso   1.00
H2519  H     0.41909   0.52360  -0.60731   0.00000  Uiso   1.00
C2520  C     0.40912   0.60264  -0.61445   0.00000  Uiso   1.00
C2521  C     0.40859   0.59524  -0.60877   0.00000  Uiso   1.00
C2522  C     0.41211   0.58712  -0.61135   0.00000  Uiso   1.00
C2523  C     0.41632   0.58626  -0.61986   0.00000  Uiso   1.00
C2524  C     0.41681   0.59387  -0.62556   0.00000  Uiso   1.00
C2525  C     0.41322   0.60192  -0.62281   0.00000  Uiso   1.00
C2526  C     0.41985   0.57818  -0.62252   0.00000  Uiso   1.00
N2527  N     0.42377   0.57784  -0.63063   0.00000  Uiso   1.00
C2528  C     0.42710   0.56977  -0.63285   0.00000  Uiso   1.00
N2529  N     0.42674   0.56238  -0.62771   0.00000  Uiso   1.00
C2530  C     0.42266   0.56353  -0.61976   0.00000  Uiso   1.00
N2531  N     0.41910   0.57125  -0.61681   0.00000  Uiso   1.00
H2532  H     0.41161   0.58141  -0.60679   0.00000  Uiso   1.00
H2533  H     0.41999   0.59347  -0.63215   0.00000  Uiso   1.00
H2534  H     0.40536   0.59592  -0.60222   0.00000  Uiso   1.00
H2535  H     0.41358   0.60779  -0.62719   0.00000  Uiso   1.00
C2536  C     0.43952   0.56742  -0.65772   0.00000  Uiso   1.00
C2537  C     0.43598   0.57564  -0.65509   0.00000  Uiso   1.00
C2538  C     0.43186   0.57653  -0.64687   0.00000  Uiso   1.00
C2539  C     0.43120   0.56900  -0.64107   0.00000  Uiso   1.00
C2540  C     0.43486   0.56067  -0.64386   0.00000  Uiso   1.00
C2541  C     0.43894   0.55998  -0.65211   0.00000  Uiso   1.00
H2542  H     0.42913   0.58305  -0.64495   0.00000  Uiso   1.00
H2543  H     0.43448   0.55474  -0.63957   0.00000  Uiso   1.00
H2544  H     0.43650   0.58142  -0.65957   0.00000  Uiso   1.00
H2545  H     0.44176   0.55356  -0.65428   0.00000  Uiso   1.00
C2546  C     0.42150   0.51012  -0.53767   0.00000  Uiso   1.00
C2547  C     0.42048   0.50146  -0.54101   0.00000  Uiso   1.00
C2548  C     0.41987   0.50000  -0.55011   0.00000  Uiso   1.00
C2549  C     0.42030   0.50738  -0.55612   0.00000  Uiso   1.00
C2550  C     0.42137   0.51616  -0.55260   0.00000  Uiso   1.00
C2551  C     0.42195   0.51742  -0.54347   0.00000  Uiso   1.00
H2552  H     0.41906   0.49315  -0.55256   0.00000  Uiso   1.00
H2553  H     0.42172   0.52200  -0.55702   0.00000  Uiso   1.00
H2554  H     0.42015   0.49579  -0.53636   0.00000  Uiso   1.00
H2555  H     0.42276   0.52418  -0.54075   0.00000  Uiso   1.00
C2556  C     0.41942   0.51159  -0.57933   0.00000  Uiso   1.00
N2557  N     0.41835   0.50342  -0.58299   0.00000  Uiso   1.00
C2558  C     0.41797   0.49667  -0.57703   0.00000  Uiso   1.00
N2559  N     0.41858   0.49757  -0.56809   0.00000  Uiso   1.00
C2560  C     0.41964   0.50604  -0.56522   0.00000  Uiso   1.00
N2561  N     0.42010   0.51330  -0.57051   0.00000  Uiso   1.00
C2562  C     0.41419   0.47060  -0.58696   0.00000  Uiso   1.00
C2563  C     0.41482   0.47811  -0.59285   0.00000  Uiso   1.00
C2564  C     0.41608   0.48657  -0.58969   0.00000  Uiso   1.00
C2565  C     0.41684   0.48812  -0.58032   0.00000  Uiso   1.00
C2566  C     0.41634   0.48072  -0.57436   0.00000  Uiso   1.00
C2567  C     0.41507   0.47229  -0.57759   0.00000  Uiso   1.00
H2568  H     0.41642   0.49213  -0.59445   0.00000  Uiso   1.00
H2569  H     0.41693   0.48167  -0.56711   0.00000  Uiso   1.00
H2570  H     0.41410   0.47716  -0.60009   0.00000  Uiso   1.00
H2571  H     0.41476   0.46674  -0.57281   0.00000  Uiso   1.00
H2572  H     0.40630   0.60906  -0.61233   0.00000  Uiso   1.00
H2573  H     0.44278   0.56679  -0.66425   0.00000  Uiso   1.00
H2574  H     0.42197   0.51119  -0.53044   0.00000  Uiso   1.00
C2575  C     0.46334   0.43332  -0.70140   0.00000  Uiso   1.00
C2576  C     0.45774   0.44026  -0.70483   0.00000  Uiso   1.00
C2577  C     0.46077   0.44620  -0.71106   0.00000  Uiso   1.00
C2578  C     0.46970   0.44562  -0.71428   0.00000  Uiso   1.00
C2579  C     0.47541   0.43878  -0.71091   0.00000  Uiso   1.00
C2580  C     0.47230   0.43286  -0.70471   0.00000  Uiso   1.00
H2581  H     0.45620   0.45138  -0.71353   0.00000  Uiso   1.00
H2582  H     0.48233   0.43817  -0.71325   0.00000  Uiso   1.00
C2583  C     0.46010   0.42701  -0.69493   0.00000  Uiso   1.00
C2584  C     0.46316   0.41796  -0.69485   0.00000  Uiso   1.00
C2585  C     0.46013   0.41194  -0.68870   0.00000  Uiso   1.00
C2586  C     0.45381   0.41462  -0.68210   0.00000  Uiso   1.00
C2587  C     0.45065   0.42360  -0.68208   0.00000  Uiso   1.00
C2588  C     0.45370   0.42954  -0.68829   0.00000  Uiso   1.00
H2589  H     0.45079   0.44082  -0.70256   0.00000  Uiso   1.00
H2590  H     0.47689   0.42772  -0.70220   0.00000  Uiso   1.00
H2591  H     0.46799   0.41567  -0.69987   0.00000  Uiso   1.00
H2592  H     0.46269   0.40508  -0.68890   0.00000  Uiso   1.00
H2593  H     0.44580   0.42586  -0.67707   0.00000  Uiso   1.00
H2594  H     0.45122   0.43644  -0.68802   0.00000  Uiso   1.00
C2595  C     0.51021   0.45473  -0.73881   0.00000  Uiso   1.00
C2596  C     0.50710   0.44868  -0.73241   0.00000  Uiso   1.00
C2597  C     0.49845   0.44926  -0.72927   0.00000  Uiso   1.00
C2598  C     0.49265   0.45606  -0.73256   0.00000  Uiso   1.00
C2599  C     0.49594   0.46219  -0.73907   0.00000  Uiso   1.00
C2600  C     0.50463   0.46145  -0.74210   0.00000  Uiso   1.00
C2601  C     0.48398   0.45670  -0.72949   0.00000  Uiso   1.00
N2602  N     0.47886   0.46328  -0.73288   0.00000  Uiso   1.00
C2603  C     0.47047   0.46356  -0.72961   0.00000  Uiso   1.00
N2604  N     0.46708   0.45792  -0.72347   0.00000  Uiso   1.00
C2605  C     0.47281   0.45161  -0.72058   0.00000  Uiso   1.00
N2606  N     0.48133   0.45067  -0.72333   0.00000  Uiso   1.00
H2607  H     0.49616   0.44443  -0.72425   0.00000  Uiso   1.00
H2608  H     0.49168   0.46751  -0.74176   0.00000  Uiso   1.00
H2609  H     0.51158   0.44344  -0.72989   0.00000  Uiso   1.00
H2610  H     0.50718   0.46615  -0.74712   0.00000  Uiso   1.00
C2611  C     0.45355   0.48348  -0.73937   0.00000  Uiso   1.00
C2612  C     0.46231   0.48290  -0.74255   0.00000  Uiso   1.00
C2613  C     0.46799   0.47635  -0.73937   0.00000  Uiso   1.00
C2614  C     0.46490   0.47016  -0.73283   0.00000  Uiso   1.00
C2615  C     0.45594   0.47086  -0.72965   0.00000  Uiso   1.00
C2616  C     0.45041   0.47748  -0.73294   0.00000  Uiso   1.00
H2617  H     0.47484   0.47602  -0.74196   0.00000  Uiso   1.00
H2618  H     0.45333   0.46622  -0.72461   0.00000  Uiso   1.00
H2619  H     0.46467   0.48766  -0.74759   0.00000  Uiso   1.00
H2620  H     0.44352   0.47804  -0.73051   0.00000  Uiso   1.00
C2621  C     0.46097   0.36856  -0.66983   0.00000  Uiso   1.00
C2622  C     0.45482   0.37116  -0.66331   0.00000  Uiso   1.00
C2623  C     0.45152   0.37978  -0.66319   0.00000  Uiso   1.00
C2624  C     0.45440   0.38605  -0.66976   0.00000  Uiso   1.00
C2625  C     0.46068   0.38328  -0.67636   0.00000  Uiso   1.00
C2626  C     0.46387   0.37461  -0.67632   0.00000  Uiso   1.00
H2627  H     0.44671   0.38168  -0.65800   0.00000  Uiso   1.00
H2628  H     0.46307   0.38791  -0.68151   0.00000  Uiso   1.00
H2629  H     0.45262   0.36632  -0.65827   0.00000  Uiso   1.00
H2630  H     0.46871   0.37246  -0.68139   0.00000  Uiso   1.00
C2631  C     0.45087   0.40860  -0.67575   0.00000  Uiso   1.00
N2632  N     0.44496   0.41157  -0.66963   0.00000  Uiso   1.00
C2633  C     0.44241   0.40542  -0.66357   0.00000  Uiso   1.00
N2634  N     0.44529   0.39689  -0.66328   0.00000  Uiso   1.00
C2635  C     0.45118   0.39468  -0.66973   0.00000  Uiso   1.00
N2636  N     0.45421   0.40025  -0.67613   0.00000  Uiso   1.00
C2637  C     0.42528   0.41391  -0.64292   0.00000  Uiso   1.00
C2638  C     0.42788   0.41982  -0.64995   0.00000  Uiso   1.00
C2639  C     0.43330   0.41707  -0.65676   0.00000  Uiso   1.00
C2640  C     0.43647   0.40810  -0.65703   0.00000  Uiso   1.00
C2641  C     0.43371   0.40202  -0.65025   0.00000  Uiso   1.00
C2642  C     0.42830   0.40485  -0.64347   0.00000  Uiso   1.00
H2643  H     0.43528   0.42192  -0.66189   0.00000  Uiso   1.00
H2644  H     0.43604   0.39507  -0.65025   0.00000  Uiso   1.00
H2645  H     0.42570   0.42682  -0.64987   0.00000  Uiso   1.00
H2646  H     0.42661   0.40008  -0.63817   0.00000  Uiso   1.00
H2647  H     0.51710   0.45420  -0.74126   0.00000  Uiso   1.00
H2648  H     0.44910   0.48870  -0.74194   0.00000  Uiso   1.00
H2649  H     0.46354   0.36169  -0.66987   0.00000  Uiso   1.00
C2650  C     0.53284   0.34679  -0.64005   0.00000  Uiso   1.00
C2651  C     0.52716   0.33938  -0.63803   0.00000  Uiso   1.00
C2652  C     0.52428   0.33362  -0.64451   0.00000  Uiso   1.00
C2653  C     0.52692   0.33489  -0.65357   0.00000  Uiso   1.00
C2654  C     0.53256   0.34224  -0.65573   0.00000  Uiso   1.00
C2655  C     0.53541   0.34792  -0.64920   0.00000  Uiso   1.00
H2656  H     0.51994   0.32803  -0.64261   0.00000  Uiso   1.00
H2657  H     0.53469   0.34344  -0.66265   0.00000  Uiso   1.00
C2658  C     0.53560   0.35303  -0.63327   0.00000  Uiso   1.00
C2659  C     0.54391   0.35770  -0.63391   0.00000  Uiso   1.00
C2660  C     0.54619   0.36427  -0.62800   0.00000  Uiso   1.00
C2661  C     0.54022   0.36670  -0.62100   0.00000  Uiso   1.00
C2662  C     0.53212   0.36182  -0.61996   0.00000  Uiso   1.00
C2663  C     0.52993   0.35524  -0.62589   0.00000  Uiso   1.00
H2664  H     0.52502   0.33818  -0.63111   0.00000  Uiso   1.00
H2665  H     0.53963   0.35360  -0.65115   0.00000  Uiso   1.00
H2666  H     0.54857   0.35618  -0.63937   0.00000  Uiso   1.00
H2667  H     0.55250   0.36786  -0.62897   0.00000  Uiso   1.00
H2668  H     0.52736   0.36352  -0.61464   0.00000  Uiso   1.00
H2669  H     0.52344   0.35191  -0.62513   0.00000  Uiso   1.00
C2670  C     0.53216   0.32873  -0.70110   0.00000  Uiso   1.00
C2671  C     0.53493   0.33466  -0.69445   0.00000  Uiso   1.00
C2672  C     0.53224   0.33344  -0.68570   0.00000  Uiso   1.00
C2673  C     0.52661   0.32609  -0.68345   0.00000  Uiso   1.00
C2674  C     0.52382   0.32012  -0.69033   0.00000  Uiso   1.00
C2675  C     0.52662   0.32150  -0.69902   0.00000  Uiso   1.00
C2676  C     0.52392   0.32479  -0.67473   0.00000  Uiso   1.00
N2677  N     0.51858   0.31774  -0.67305   0.00000  Uiso   1.00
C2678  C     0.51618   0.31682  -0.66441   0.00000  Uiso   1.00
N2679  N     0.51872   0.32226  -0.65768   0.00000  Uiso   1.00
C2680  C     0.52406   0.32908  -0.66016   0.00000  Uiso   1.00
N2681  N     0.52687   0.33068  -0.66857   0.00000  Uiso   1.00
H2682  H     0.53451   0.33818  -0.68059   0.00000  Uiso   1.00
H2683  H     0.51950   0.31439  -0.68887   0.00000  Uiso   1.00
H2684  H     0.53926   0.34031  -0.69619   0.00000  Uiso   1.00
H2685  H     0.52451   0.31691  -0.70433   0.00000  Uiso   1.00
C2686  C     0.49963   0.29530  -0.65794   0.00000  Uiso   1.00
C2687  C     0.50231   0.29657  -0.66679   0.00000  Uiso   1.00
C2688  C     0.50776   0.30367  -0.66904   0.00000  Uiso   1.00
C2689  C     0.51069   0.30972  -0.66229   0.00000  Uiso   1.00
C2690  C     0.50788   0.30833  -0.65329   0.00000  Uiso   1.00
C2691  C     0.50241   0.30118  -0.65125   0.00000  Uiso   1.00
H2692  H     0.50978   0.30452  -0.67603   0.00000  Uiso   1.00
H2693  H     0.50998   0.31286  -0.64793   0.00000  Uiso   1.00
H2694  H     0.50006   0.29189  -0.67197   0.00000  Uiso   1.00
H2695  H     0.50024   0.30010  -0.64433   0.00000  Uiso   1.00
C2696  C     0.57324   0.40164  -0.61771   0.00000  Uiso   1.00
C2697  C     0.56714   0.40441  -0.61121   0.00000  Uiso   1.00
C2698  C     0.55968   0.39930  -0.60934   0.00000  Uiso   1.00
C2699  C     0.55816   0.39121  -0.61413   0.00000  Uiso   1.00
C2700  C     0.56446   0.38850  -0.62075   0.00000  Uiso   1.00
C2701  C     0.57188   0.39371  -0.62244   0.00000  Uiso   1.00
H2702  H     0.55499   0.40161  -0.60421   0.00000  Uiso   1.00
H2703  H     0.56349   0.38233  -0.62459   0.00000  Uiso   1.00
H2704  H     0.56833   0.41065  -0.60755   0.00000  Uiso   1.00
H2705  H     0.57673   0.39164  -0.62753   0.00000  Uiso   1.00
C2706  C     0.54194   0.37413  -0.61577   0.00000  Uiso   1.00
N2707  N     0.53580   0.37638  -0.60959   0.00000  Uiso   1.00
C2708  C     0.53764   0.38395  -0.60505   0.00000  Uiso   1.00
N2709  N     0.54491   0.38912  -0.60625   0.00000  Uiso   1.00
C2710  C     0.55063   0.38614  -0.61253   0.00000  Uiso   1.00
N2711  N     0.54950   0.37872  -0.61750   0.00000  Uiso   1.00
C2712  C     0.51848   0.39290  -0.58647   0.00000  Uiso   1.00
C2713  C     0.51744   0.38462  -0.59110   0.00000  Uiso   1.00
C2714  C     0.52362   0.38166  -0.59712   0.00000  Uiso   1.00
C2715  C     0.53146   0.38676  -0.59879   0.00000  Uiso   1.00
C2716  C     0.53276   0.39492  -0.59407   0.00000  Uiso   1.00
C2717  C     0.52646   0.39785  -0.58819   0.00000  Uiso   1.00
H2718  H     0.52242   0.37533  -0.60061   0.00000  Uiso   1.00
H2719  H     0.53873   0.39902  -0.59521   0.00000  Uiso   1.00
H2720  H     0.51153   0.38043  -0.58997   0.00000  Uiso   1.00
H2721  H     0.52762   0.40432  -0.58493   0.00000  Uiso   1.00
H2722  H     0.53434   0.32976  -0.70802   0.00000  Uiso   1.00
H2723  H     0.49530   0.28964  -0.65623   0.00000  Uiso   1.00
H2724  H     0.57917   0.40572  -0.61911   0.00000  Uiso   1.00
C2725  C     0.50712   0.39557  -0.54507   0.00000  Uiso   1.00
C2726  C     0.51022   0.40160  -0.53835   0.00000  Uiso   1.00
C2727  C     0.50446   0.40613  -0.53293   0.00000  Uiso   1.00
C2728  C     0.49507   0.40488  -0.53384   0.00000  Uiso   1.00
C2729  C     0.49183   0.39881  -0.54040   0.00000  Uiso   1.00
C2730  C     0.49767   0.39434  -0.54579   0.00000  Uiso   1.00
H2731  H     0.50716   0.41077  -0.52793   0.00000  Uiso   1.00
H2732  H     0.48464   0.39774  -0.54131   0.00000  Uiso   1.00
C2733  C     0.51321   0.39121  -0.55112   0.00000  Uiso   1.00
C2734  C     0.51105   0.38288  -0.55525   0.00000  Uiso   1.00
C2735  C     0.51649   0.37906  -0.56149   0.00000  Uiso   1.00
C2736  C     0.52461   0.38332  -0.56401   0.00000  Uiso   1.00
C2737  C     0.52699   0.39153  -0.55983   0.00000  Uiso   1.00
C2738  C     0.52149   0.39528  -0.55361   0.00000  Uiso   1.00
H2739  H     0.51741   0.40274  -0.53745   0.00000  Uiso   1.00
H2740  H     0.49490   0.38990  -0.55093   0.00000  Uiso   1.00
H2741  H     0.50482   0.37941  -0.55351   0.00000  Uiso   1.00
H2742  H     0.51446   0.37272  -0.56457   0.00000  Uiso   1.00
H2743  H     0.53318   0.39502  -0.56163   0.00000  Uiso   1.00
H2744  H     0.52342   0.40176  -0.55075   0.00000  Uiso   1.00
C2745  C     0.44750   0.40946  -0.52817   0.00000  Uiso   1.00
C2746  C     0.45352   0.40440  -0.53320   0.00000  Uiso   1.00
C2747  C     0.46261   0.40556  -0.53211   0.00000  Uiso   1.00
C2748  C     0.46586   0.41187  -0.52577   0.00000  Uiso   1.00
C2749  C     0.45962   0.41692  -0.52064   0.00000  Uiso   1.00
C2750  C     0.45056   0.41568  -0.52192   0.00000  Uiso   1.00
C2751  C     0.47493   0.41306  -0.52463   0.00000  Uiso   1.00
N2752  N     0.47762   0.41901  -0.51843   0.00000  Uiso   1.00
C2753  C     0.48656   0.41986  -0.51769   0.00000  Uiso   1.00
N2754  N     0.49265   0.41538  -0.52258   0.00000  Uiso   1.00
C2755  C     0.48917   0.40963  -0.52856   0.00000  Uiso   1.00
N2756  N     0.48039   0.40817  -0.52987   0.00000  Uiso   1.00
H2757  H     0.46720   0.40154  -0.53616   0.00000  Uiso   1.00
H2758  H     0.46188   0.42184  -0.51570   0.00000  Uiso   1.00
H2759  H     0.45100   0.39951  -0.53804   0.00000  Uiso   1.00
H2760  H     0.44574   0.41958  -0.51802   0.00000  Uiso   1.00
C2761  C     0.49618   0.43845  -0.49923   0.00000  Uiso   1.00
C2762  C     0.48698   0.43709  -0.50007   0.00000  Uiso   1.00
C2763  C     0.48370   0.43087  -0.50605   0.00000  Uiso   1.00
C2764  C     0.48974   0.42586  -0.51145   0.00000  Uiso   1.00
C2765  C     0.49910   0.42729  -0.51047   0.00000  Uiso   1.00
C2766  C     0.50219   0.43354  -0.50443   0.00000  Uiso   1.00
H2767  H     0.47645   0.42998  -0.50663   0.00000  Uiso   1.00
H2768  H     0.50394   0.42358  -0.51455   0.00000  Uiso   1.00
H2769  H     0.48233   0.44106  -0.49604   0.00000  Uiso   1.00
H2770  H     0.50940   0.43470  -0.50371   0.00000  Uiso   1.00
C2771  C     0.52549   0.34541  -0.59391   0.00000  Uiso   1.00
C2772  C     0.53348   0.34967  -0.59621   0.00000  Uiso   1.00
C2773  C     0.53610   0.35732  -0.59176   0.00000  Uiso   1.00
C2774  C     0.53061   0.36092  -0.58486   0.00000  Uiso   1.00
C2775  C     0.52251   0.35647  -0.58259   0.00000  Uiso   1.00
C2776  C     0.52006   0.34881  -0.58713   0.00000  Uiso   1.00
H2777  H     0.54237   0.36059  -0.59371   0.00000  Uiso   1.00
H2778  H     0.51811   0.35905  -0.57733   0.00000  Uiso   1.00
H2779  H     0.53766   0.34692  -0.60155   0.00000  Uiso   1.00
H2780  H     0.51381   0.34538  -0.58541   0.00000  Uiso   1.00
C2781  C     0.53004   0.37966  -0.57052   0.00000  Uiso   1.00
N2782  N     0.53753   0.38420  -0.57264   0.00000  Uiso   1.00
C2783  C     0.54262   0.38032  -0.57897   0.00000  Uiso   1.00
N2784  N     0.54073   0.37260  -0.58317   0.00000  Uiso   1.00
C2785  C     0.53301   0.36872  -0.58059   0.00000  Uiso   1.00
N2786  N     0.52742   0.37192  -0.57429   0.00000  Uiso   1.00
C2787  C     0.56672   0.39326  -0.58562   0.00000  Uiso   1.00
C2788  C     0.56045   0.39716  -0.57958   0.00000  Uiso   1.00
C2789  C     0.55264   0.39300  -0.57741   0.00000  Uiso   1.00
C2790  C     0.55040   0.38466  -0.58138   0.00000  Uiso   1.00
C2791  C     0.55638   0.38082  -0.58771   0.00000  Uiso   1.00
C2792  C     0.56426   0.38498  -0.58967   0.00000  Uiso   1.00
H2793  H     0.54814   0.39621  -0.57258   0.00000  Uiso   1.00
H2794  H     0.55484   0.37441  -0.59092   0.00000  Uiso   1.00
H2795  H     0.56183   0.40361  -0.57638   0.00000  Uiso   1.00
H2796  H     0.56882   0.38160  -0.59431   0.00000  Uiso   1.00
H2797  H     0.44029   0.40852  -0.52912   0.00000  Uiso   1.00
H2798  H     0.49870   0.44343  -0.49449   0.00000  Uiso   1.00
H2799  H     0.52348   0.33933  -0.59747   0.00000  Uiso   1.00
C2800  C     0.70310   0.39856  -0.65121   0.00000  Uiso   1.00
C2801  C     0.70682   0.40530  -0.64555   0.00000  Uiso   1.00
C2802  C     0.71580   0.40592  -0.64411   0.00000  Uiso   1.00
C2803  C     0.72174   0.39974  -0.64823   0.00000  Uiso   1.00
C2804  C     0.71818   0.39297  -0.65390   0.00000  Uiso   1.00
C2805  C     0.70919   0.39245  -0.65534   0.00000  Uiso   1.00
H2806  H     0.71834   0.41120  -0.63971   0.00000  Uiso   1.00
H2807  H     0.72258   0.38809  -0.65716   0.00000  Uiso   1.00
C2808  C     0.69362   0.39786  -0.65259   0.00000  Uiso   1.00
C2809  C     0.68997   0.39491  -0.66092   0.00000  Uiso   1.00
C2810  C     0.68098   0.39418  -0.66223   0.00000  Uiso   1.00
C2811  C     0.67493   0.39633  -0.65519   0.00000  Uiso   1.00
C2812  C     0.67842   0.39926  -0.64683   0.00000  Uiso   1.00
C2813  C     0.68742   0.40002  -0.64563   0.00000  Uiso   1.00
H2814  H     0.70242   0.41020  -0.64231   0.00000  Uiso   1.00
H2815  H     0.70664   0.38708  -0.65965   0.00000  Uiso   1.00
H2816  H     0.69446   0.39326  -0.66649   0.00000  Uiso   1.00
H2817  H     0.67850   0.39192  -0.66875   0.00000  Uiso   1.00
H2818  H     0.67395   0.40096  -0.64127   0.00000  Uiso   1.00
H2819  H     0.68990   0.40220  -0.63907   0.00000  Uiso   1.00
C2820  C     0.76184   0.37636  -0.66110   0.00000  Uiso   1.00
C2821  C     0.75266   0.37600  -0.66274   0.00000  Uiso   1.00
C2822  C     0.74698   0.38213  -0.65882   0.00000  Uiso   1.00
C2823  C     0.75050   0.38886  -0.65308   0.00000  Uiso   1.00
C2824  C     0.75989   0.38916  -0.65151   0.00000  Uiso   1.00
C2825  C     0.76541   0.38293  -0.65550   0.00000  Uiso   1.00
C2826  C     0.74486   0.39496  -0.64908   0.00000  Uiso   1.00
N2827  N     0.74858   0.40120  -0.64374   0.00000  Uiso   1.00
C2828  C     0.74270   0.40694  -0.64003   0.00000  Uiso   1.00
N2829  N     0.73378   0.40679  -0.64128   0.00000  Uiso   1.00
C2830  C     0.73084   0.40026  -0.64673   0.00000  Uiso   1.00
N2831  N     0.73606   0.39417  -0.65083   0.00000  Uiso   1.00
H2832  H     0.73980   0.38170  -0.66020   0.00000  Uiso   1.00
H2833  H     0.76284   0.39424  -0.64712   0.00000  Uiso   1.00
H2834  H     0.74996   0.37080  -0.66715   0.00000  Uiso   1.00
H2835  H     0.77264   0.38311  -0.65428   0.00000  Uiso   1.00
C2836  C     0.75284   0.42671  -0.62316   0.00000  Uiso   1.00
C2837  C     0.75868   0.42063  -0.62717   0.00000  Uiso   1.00
C2838  C     0.75543   0.41406  -0.63279   0.00000  Uiso   1.00
C2839  C     0.74608   0.41348  -0.63449   0.00000  Uiso   1.00
C2840  C     0.74022   0.41976  -0.63035   0.00000  Uiso   1.00
C2841  C     0.74366   0.42625  -0.62476   0.00000  Uiso   1.00
H2842  H     0.76014   0.40936  -0.63586   0.00000  Uiso   1.00
H2843  H     0.73299   0.41952  -0.63150   0.00000  Uiso   1.00
H2844  H     0.76587   0.42109  -0.62584   0.00000  Uiso   1.00
H2845  H     0.73916   0.43108  -0.62156   0.00000  Uiso   1.00
C2846  C     0.64376   0.38384  -0.68986   0.00000  Uiso   1.00
C2847  C     0.63790   0.38592  -0.68289   0.00000  Uiso   1.00
C2848  C     0.64118   0.38872  -0.67473   0.00000  Uiso   1.00
C2849  C     0.65058   0.38948  -0.67341   0.00000  Uiso   1.00
C2850  C     0.65645   0.38733  -0.68059   0.00000  Uiso   1.00
C2851  C     0.65299   0.38455  -0.68868   0.00000  Uiso   1.00
H2852  H     0.63644   0.39032  -0.66937   0.00000  Uiso   1.00
H2853  H     0.66372   0.38784  -0.67982   0.00000  Uiso   1.00
H2854  H     0.63066   0.38533  -0.68394   0.00000  Uiso   1.00
H2855  H     0.65750   0.38289  -0.69422   0.00000  Uiso   1.00
C2856  C     0.66581   0.39558  -0.65643   0.00000  Uiso   1.00
N2857  N     0.66052   0.39768  -0.64945   0.00000  Uiso   1.00
C2858  C     0.65168   0.39684  -0.65102   0.00000  Uiso   1.00
N2859  N     0.64801   0.39417  -0.65879   0.00000  Uiso   1.00
C2860  C     0.65395   0.39224  -0.66529   0.00000  Uiso   1.00
N2861  N     0.66292   0.39282  -0.66450   0.00000  Uiso   1.00
C2862  C     0.63427   0.40360  -0.62997   0.00000  Uiso   1.00
C2863  C     0.64376   0.40410  -0.62895   0.00000  Uiso   1.00
C2864  C     0.64942   0.40186  -0.63573   0.00000  Uiso   1.00
C2865  C     0.64595   0.39894  -0.64409   0.00000  Uiso   1.00
C2866  C     0.63652   0.39832  -0.64523   0.00000  Uiso   1.00
C2867  C     0.63092   0.40056  -0.63839   0.00000  Uiso   1.00
H2868  H     0.65666   0.40240  -0.63463   0.00000  Uiso   1.00
H2869  H     0.63364   0.39608  -0.65159   0.00000  Uiso   1.00
H2870  H     0.64668   0.40628  -0.62258   0.00000  Uiso   1.00
H2871  H     0.62368   0.40014  -0.63951   0.00000  Uiso   1.00
H2872  H     0.76628   0.37145  -0.66423   0.00000  Uiso   1.00
H2873  H     0.75549   0.43189  -0.61870   0.00000  Uiso   1.00
H2874  H     0.64108   0.38162  -0.69631   0.00000  Uiso   1.00
C2875  C     0.74432   0.45874  -0.55697   0.00000  Uiso   1.00
C2876  C     0.74448   0.45071  -0.55177   0.00000  Uiso   1.00
C2877  C     0.75018   0.44387  -0.55373   0.00000  Uiso   1.00
C2878  C     0.75611   0.44456  -0.56114   0.00000  Uiso   1.00
C2879  C     0.75602   0.45248  -0.56644   0.00000  Uiso   1.00
C2880  C     0.75036   0.45932  -0.56437   0.00000  Uiso   1.00
H2881  H     0.75009   0.43786  -0.54954   0.00000  Uiso   1.00
H2882  H     0.76050   0.45320  -0.57220   0.00000  Uiso   1.00
C2883  C     0.73824   0.46586  -0.55494   0.00000  Uiso   1.00
C2884  C     0.74080   0.47504  -0.55589   0.00000  Uiso   1.00
C2885  C     0.73495   0.48182  -0.55414   0.00000  Uiso   1.00
C2886  C     0.72603   0.47986  -0.55146   0.00000  Uiso   1.00
C2887  C     0.72336   0.47078  -0.55047   0.00000  Uiso   1.00
C2888  C     0.72931   0.46407  -0.55205   0.00000  Uiso   1.00
H2889  H     0.73998   0.45000  -0.54601   0.00000  Uiso   1.00
H2890  H     0.75038   0.46531  -0.56860   0.00000  Uiso   1.00
H2891  H     0.74762   0.47672  -0.55801   0.00000  Uiso   1.00
H2892  H     0.73720   0.48875  -0.55496   0.00000  Uiso   1.00
H2893  H     0.71654   0.46906  -0.54839   0.00000  Uiso   1.00
H2894  H     0.72706   0.45714  -0.55128   0.00000  Uiso   1.00
C2895  C     0.78958   0.43406  -0.59417   0.00000  Uiso   1.00
C2896  C     0.78372   0.44102  -0.59208   0.00000  Uiso   1.00
C2897  C     0.77816   0.44039  -0.58474   0.00000  Uiso   1.00
C2898  C     0.77839   0.43259  -0.57928   0.00000  Uiso   1.00
C2899  C     0.78441   0.42555  -0.58151   0.00000  Uiso   1.00
C2900  C     0.78990   0.42636  -0.58889   0.00000  Uiso   1.00
C2901  C     0.77281   0.43186  -0.57198   0.00000  Uiso   1.00
N2902  N     0.77332   0.42431  -0.56709   0.00000  Uiso   1.00
C2903  C     0.76768   0.42399  -0.56008   0.00000  Uiso   1.00
N2904  N     0.76182   0.43045  -0.55779   0.00000  Uiso   1.00
C2905  C     0.76194   0.43768  -0.56315   0.00000  Uiso   1.00
N2906  N     0.76728   0.43878  -0.57031   0.00000  Uiso   1.00
H2907  H     0.77362   0.44594  -0.58325   0.00000  Uiso   1.00
H2908  H     0.78476   0.41945  -0.57747   0.00000  Uiso   1.00
H2909  H     0.78356   0.44702  -0.59630   0.00000  Uiso   1.00
H2910  H     0.79453   0.42096  -0.59063   0.00000  Uiso   1.00
C2911  C     0.76854   0.40121  -0.54399   0.00000  Uiso   1.00
C2912  C     0.77420   0.40186  -0.55139   0.00000  Uiso   1.00
C2913  C     0.77396   0.40935  -0.55679   0.00000  Uiso   1.00
C2914  C     0.76792   0.41644  -0.55480   0.00000  Uiso   1.00
C2915  C     0.76218   0.41564  -0.54725   0.00000  Uiso   1.00
C2916  C     0.76256   0.40808  -0.54196   0.00000  Uiso   1.00
H2917  H     0.77849   0.40972  -0.56254   0.00000  Uiso   1.00
H2918  H     0.75745   0.42096  -0.54551   0.00000  Uiso   1.00
H2919  H     0.77886   0.39640  -0.55289   0.00000  Uiso   1.00
H2920  H     0.75815   0.40746  -0.53613   0.00000  Uiso   1.00
C2921  C     0.72456   0.52808  -0.55189   0.00000  Uiso   1.00
C2922  C     0.71578   0.52609  -0.54944   0.00000  Uiso   1.00
C2923  C     0.71308   0.51731  -0.54849   0.00000  Uiso   1.00
C2924  C     0.71928   0.51025  -0.55003   0.00000  Uiso   1.00
C2925  C     0.72824   0.51241  -0.55247   0.00000  Uiso   1.00
C2926  C     0.73074   0.52125  -0.55338   0.00000  Uiso   1.00
H2927  H     0.70614   0.51591  -0.54659   0.00000  Uiso   1.00
H2928  H     0.73320   0.50716  -0.55370   0.00000  Uiso   1.00
H2929  H     0.71101   0.53154  -0.54828   0.00000  Uiso   1.00
H2930  H     0.73762   0.52292  -0.55529   0.00000  Uiso   1.00
C2931  C     0.71997   0.48667  -0.54993   0.00000  Uiso   1.00
N2932  N     0.71158   0.48427  -0.54774   0.00000  Uiso   1.00
C2933  C     0.70592   0.49114  -0.54639   0.00000  Uiso   1.00
N2934  N     0.70808   0.49986  -0.54701   0.00000  Uiso   1.00
C2935  C     0.71667   0.50145  -0.54923   0.00000  Uiso   1.00
N2936  N     0.72290   0.49513  -0.55082   0.00000  Uiso   1.00
C2937  C     0.67899   0.48467  -0.54157   0.00000  Uiso   1.00
C2938  C     0.68563   0.47788  -0.54261   0.00000  Uiso   1.00
C2939  C     0.69440   0.47994  -0.54397   0.00000  Uiso   1.00
C2940  C     0.69716   0.48904  -0.54437   0.00000  Uiso   1.00
C2941  C     0.69071   0.49591  -0.54303   0.00000  Uiso   1.00
C2942  C     0.68195   0.49376  -0.54161   0.00000  Uiso   1.00
H2943  H     0.69920   0.47449  -0.54496   0.00000  Uiso   1.00
H2944  H     0.69264   0.50298  -0.54329   0.00000  Uiso   1.00
H2945  H     0.68368   0.47080  -0.54257   0.00000  Uiso   1.00
H2946  H     0.67707   0.49920  -0.54096   0.00000  Uiso   1.00
H2947  H     0.79396   0.43463  -0.60001   0.00000  Uiso   1.00
H2948  H     0.76878   0.39524  -0.53975   0.00000  Uiso   1.00
H2949  H     0.72663   0.53506  -0.55265   0.00000  Uiso   1.00
C2950  C     0.67193   0.45564  -0.60553   0.00000  Uiso   1.00
C2951  C     0.66360   0.45203  -0.60858   0.00000  Uiso   1.00
C2952  C     0.66085   0.45306  -0.61721   0.00000  Uiso   1.00
C2953  C     0.66620   0.45794  -0.62339   0.00000  Uiso   1.00
C2954  C     0.67451   0.46156  -0.62049   0.00000  Uiso   1.00
C2955  C     0.67724   0.46044  -0.61186   0.00000  Uiso   1.00
H2956  H     0.65442   0.45018  -0.61926   0.00000  Uiso   1.00
H2957  H     0.67879   0.46534  -0.62509   0.00000  Uiso   1.00
C2958  C     0.67490   0.45438  -0.59651   0.00000  Uiso   1.00
C2959  C     0.68414   0.45291  -0.59449   0.00000  Uiso   1.00
C2960  C     0.68699   0.45150  -0.58595   0.00000  Uiso   1.00
C2961  C     0.68076   0.45157  -0.57876   0.00000  Uiso   1.00
C2962  C     0.67154   0.45312  -0.58061   0.00000  Uiso   1.00
C2963  C     0.66874   0.45442  -0.58919   0.00000  Uiso   1.00
H2964  H     0.65936   0.44821  -0.60397   0.00000  Uiso   1.00
H2965  H     0.68364   0.46338  -0.60979   0.00000  Uiso   1.00
H2966  H     0.68907   0.45273  -0.59991   0.00000  Uiso   1.00
H2967  H     0.69412   0.45034  -0.58473   0.00000  Uiso   1.00
H2968  H     0.66658   0.45324  -0.57521   0.00000  Uiso   1.00
H2969  H     0.66161   0.45561  -0.59041   0.00000  Uiso   1.00
C2970  C     0.68048   0.48126  -0.66305   0.00000  Uiso   1.00
C2971  C     0.68355   0.47963  -0.65439   0.00000  Uiso   1.00
C2972  C     0.67861   0.47439  -0.64861   0.00000  Uiso   1.00
C2973  C     0.67035   0.47064  -0.65149   0.00000  Uiso   1.00
C2974  C     0.66732   0.47236  -0.66036   0.00000  Uiso   1.00
C2975  C     0.67240   0.47762  -0.66600   0.00000  Uiso   1.00
C2976  C     0.66531   0.46550  -0.64574   0.00000  Uiso   1.00
N2977  N     0.65754   0.46218  -0.64885   0.00000  Uiso   1.00
C2978  C     0.65288   0.45730  -0.64288   0.00000  Uiso   1.00
N2979  N     0.65539   0.45569  -0.63438   0.00000  Uiso   1.00
C2980  C     0.66329   0.45931  -0.63204   0.00000  Uiso   1.00
N2981  N     0.66855   0.46424  -0.63743   0.00000  Uiso   1.00
H2982  H     0.68114   0.47323  -0.64183   0.00000  Uiso   1.00
H2983  H     0.66099   0.46961  -0.66281   0.00000  Uiso   1.00
H2984  H     0.68991   0.48253  -0.65218   0.00000  Uiso   1.00
H2985  H     0.67008   0.47898  -0.67282   0.00000  Uiso   1.00
C2986  C     0.62870   0.44622  -0.65129   0.00000  Uiso   1.00
C2987  C     0.63378   0.45130  -0.65725   0.00000  Uiso   1.00
C2988  C     0.64178   0.45504  -0.65456   0.00000  Uiso   1.00
C2989  C     0.64488   0.45368  -0.64566   0.00000  Uiso   1.00
C2990  C     0.63960   0.44849  -0.63967   0.00000  Uiso   1.00
C2991  C     0.63162   0.44484  -0.64253   0.00000  Uiso   1.00
H2992  H     0.64565   0.45899  -0.65937   0.00000  Uiso   1.00
H2993  H     0.64178   0.44730  -0.63277   0.00000  Uiso   1.00
H2994  H     0.63138   0.45232  -0.66411   0.00000  Uiso   1.00
H2995  H     0.62756   0.44084  -0.63793   0.00000  Uiso   1.00
C2996  C     0.72116   0.43989  -0.55517   0.00000  Uiso   1.00
C2997  C     0.71509   0.44040  -0.54810   0.00000  Uiso   1.00
C2998  C     0.70634   0.44290  -0.54965   0.00000  Uiso   1.00
C2999  C     0.70348   0.44490  -0.55851   0.00000  Uiso   1.00
C3000  C     0.70981   0.44450  -0.56561   0.00000  Uiso   1.00
C3001  C     0.71852   0.44198  -0.56387   0.00000  Uiso   1.00
H3002  H     0.70167   0.44314  -0.54401   0.00000  Uiso   1.00
H3003  H     0.70786   0.44598  -0.57252   0.00000  Uiso   1.00
H3004  H     0.71730   0.43878  -0.54129   0.00000  Uiso   1.00
H3005  H     0.72340   0.44160  -0.56933   0.00000  Uiso   1.00
C3006  C     0.68358   0.45009  -0.57010   0.00000  Uiso   1.00
N3007  N     0.67732   0.45031  -0.56364   0.00000  Uiso   1.00
C3008  C     0.68040   0.44870  -0.55533   0.00000  Uiso   1.00
N3009  N     0.68896   0.44693  -0.55321   0.00000  Uiso   1.00
C3010  C     0.69464   0.44688  -0.56022   0.00000  Uiso   1.00
N3011  N     0.69234   0.44844  -0.56879   0.00000  Uiso   1.00
C3012  C     0.66134   0.44804  -0.53467   0.00000  Uiso   1.00
C3013  C     0.65884   0.45008  -0.54369   0.00000  Uiso   1.00
C3014  C     0.66502   0.45037  -0.55038   0.00000  Uiso   1.00
C3015  C     0.67420   0.44874  -0.54849   0.00000  Uiso   1.00
C3016  C     0.67686   0.44689  -0.53954   0.00000  Uiso   1.00
C3017  C     0.67062   0.44652  -0.53289   0.00000  Uiso   1.00
H3018  H     0.66277   0.45180  -0.55721   0.00000  Uiso   1.00
H3019  H     0.68389   0.44559  -0.53789   0.00000  Uiso   1.00
H3020  H     0.65177   0.45114  -0.54533   0.00000  Uiso   1.00
H3021  H     0.67280   0.44492  -0.52607   0.00000  Uiso   1.00
H3022  H     0.68446   0.48542  -0.66759   0.00000  Uiso   1.00
H3023  H     0.62236   0.44329  -0.65349   0.00000  Uiso   1.00
H3024  H     0.72809   0.43788  -0.55387   0.00000  Uiso   1.00
C3025  C     0.58612   0.34531  -0.45781   0.00000  Uiso   1.00
C3026  C     0.57840   0.35004  -0.45470   0.00000  Uiso   1.00
C3027  C     0.57046   0.34579  -0.45325   0.00000  Uiso   1.00
C3028  C     0.56966   0.33645  -0.45489   0.00000  Uiso   1.00
C3029  C     0.57726   0.33162  -0.45801   0.00000  Uiso   1.00
C3030  C     0.58518   0.33592  -0.45937   0.00000  Uiso   1.00
H3031  H     0.56474   0.34969  -0.45084   0.00000  Uiso   1.00
H3032  H     0.57686   0.32442  -0.45934   0.00000  Uiso   1.00
C3033  C     0.59446   0.34980  -0.45932   0.00000  Uiso   1.00
C3034  C     0.60280   0.34548  -0.45759   0.00000  Uiso   1.00
C3035  C     0.61076   0.34968  -0.45907   0.00000  Uiso   1.00
C3036  C     0.61091   0.35858  -0.46247   0.00000  Uiso   1.00
C3037  C     0.60268   0.36300  -0.46424   0.00000  Uiso   1.00
C3038  C     0.59476   0.35876  -0.46267   0.00000  Uiso   1.00
H3039  H     0.57883   0.35723  -0.45332   0.00000  Uiso   1.00
H3040  H     0.59089   0.33204  -0.46185   0.00000  Uiso   1.00
H3041  H     0.60290   0.33864  -0.45493   0.00000  Uiso   1.00
H3042  H     0.61698   0.34609  -0.45763   0.00000  Uiso   1.00
H3043  H     0.60258   0.36985  -0.46687   0.00000  Uiso   1.00
H3044  H     0.58852   0.36231  -0.46419   0.00000  Uiso   1.00
C3045  C     0.55127   0.29208  -0.45895   0.00000  Uiso   1.00
C3046  C     0.55939   0.29646  -0.46036   0.00000  Uiso   1.00
C3047  C     0.56016   0.30550  -0.45869   0.00000  Uiso   1.00
C3048  C     0.55264   0.31039  -0.45550   0.00000  Uiso   1.00
C3049  C     0.54440   0.30582  -0.45411   0.00000  Uiso   1.00
C3050  C     0.54382   0.29677  -0.45583   0.00000  Uiso   1.00
C3051  C     0.55334   0.31942  -0.45379   0.00000  Uiso   1.00
N3052  N     0.54598   0.32366  -0.45079   0.00000  Uiso   1.00
C3053  C     0.54707   0.33247  -0.44928   0.00000  Uiso   1.00
N3054  N     0.55472   0.33706  -0.45053   0.00000  Uiso   1.00
C3055  C     0.56163   0.33212  -0.45351   0.00000  Uiso   1.00
N3056  N     0.56134   0.32329  -0.45526   0.00000  Uiso   1.00
H3057  H     0.56660   0.30880  -0.45985   0.00000  Uiso   1.00
H3058  H     0.53846   0.30936  -0.45166   0.00000  Uiso   1.00
H3059  H     0.56518   0.29268  -0.46281   0.00000  Uiso   1.00
H3060  H     0.53749   0.29322  -0.45476   0.00000  Uiso   1.00
C3061  C     0.52502   0.34670  -0.43981   0.00000  Uiso   1.00
C3062  C     0.52425   0.33755  -0.44147   0.00000  Uiso   1.00
C3063  C     0.53148   0.33276  -0.44464   0.00000  Uiso   1.00
C3064  C     0.53978   0.33718  -0.44619   0.00000  Uiso   1.00
C3065  C     0.54044   0.34652  -0.44447   0.00000  Uiso   1.00
C3066  C     0.53310   0.35114  -0.44131   0.00000  Uiso   1.00
H3067  H     0.53072   0.32558  -0.44589   0.00000  Uiso   1.00
H3068  H     0.54671   0.35014  -0.44559   0.00000  Uiso   1.00
H3069  H     0.51786   0.33416  -0.44025   0.00000  Uiso   1.00
H3070  H     0.53359   0.35833  -0.43997   0.00000  Uiso   1.00
C3071  C     0.65804   0.34933  -0.45851   0.00000  Uiso   1.00
C3072  C     0.65826   0.35802  -0.46192   0.00000  Uiso   1.00
C3073  C     0.65040   0.36253  -0.46370   0.00000  Uiso   1.00
C3074  C     0.64203   0.35829  -0.46206   0.00000  Uiso   1.00
C3075  C     0.64194   0.34942  -0.45859   0.00000  Uiso   1.00
C3076  C     0.64990   0.34508  -0.45687   0.00000  Uiso   1.00
H3077  H     0.65074   0.36934  -0.46638   0.00000  Uiso   1.00
H3078  H     0.63563   0.34594  -0.45725   0.00000  Uiso   1.00
H3079  H     0.66472   0.36126  -0.46318   0.00000  Uiso   1.00
H3080  H     0.64984   0.33825  -0.45419   0.00000  Uiso   1.00
C3081  C     0.61896   0.36282  -0.46403   0.00000  Uiso   1.00
N3082  N     0.61866   0.37121  -0.46733   0.00000  Uiso   1.00
C3083  C     0.62672   0.37498  -0.46872   0.00000  Uiso   1.00
N3084  N     0.63467   0.37105  -0.46710   0.00000  Uiso   1.00
C3085  C     0.63412   0.36268  -0.46383   0.00000  Uiso   1.00
N3086  N     0.62647   0.35823  -0.46217   0.00000  Uiso   1.00
C3087  C     0.62725   0.40076  -0.47999   0.00000  Uiso   1.00
C3088  C     0.61899   0.39637  -0.47802   0.00000  Uiso   1.00
C3089  C     0.61877   0.38806  -0.47425   0.00000  Uiso   1.00
C3090  C     0.62688   0.38354  -0.47217   0.00000  Uiso   1.00
C3091  C     0.63517   0.38790  -0.47387   0.00000  Uiso   1.00
C3092  C     0.63530   0.39620  -0.47762   0.00000  Uiso   1.00
H3093  H     0.61228   0.38490  -0.47302   0.00000  Uiso   1.00
H3094  H     0.64154   0.38462  -0.47230   0.00000  Uiso   1.00
H3095  H     0.61262   0.39953  -0.47980   0.00000  Uiso   1.00
H3096  H     0.64181   0.39933  -0.47889   0.00000  Uiso   1.00
H3097  H     0.55074   0.28490  -0.46029   0.00000  Uiso   1.00
H3098  H     0.51924   0.35044  -0.43729   0.00000  Uiso   1.00
H3099  H     0.66432   0.34582  -0.45713   0.00000  Uiso   1.00
C3100  C     0.47512   0.50448  -0.43100   0.00000  Uiso   1.00
C3101  C     0.48175   0.50792  -0.42503   0.00000  Uiso   1.00
C3102  C     0.47958   0.51347  -0.41815   0.00000  Uiso   1.00
C3103  C     0.47053   0.51600  -0.41671   0.00000  Uiso   1.00
C3104  C     0.46378   0.51250  -0.42245   0.00000  Uiso   1.00
C3105  C     0.46602   0.50690  -0.42931   0.00000  Uiso   1.00
H3106  H     0.48494   0.51600  -0.41382   0.00000  Uiso   1.00
H3107  H     0.45674   0.51431  -0.42149   0.00000  Uiso   1.00
C3108  C     0.47762   0.49894  -0.43845   0.00000  Uiso   1.00
C3109  C     0.47219   0.49165  -0.44144   0.00000  Uiso   1.00
C3110  C     0.47506   0.48592  -0.44795   0.00000  Uiso   1.00
C3111  C     0.48360   0.48714  -0.45195   0.00000  Uiso   1.00
C3112  C     0.48889   0.49461  -0.44938   0.00000  Uiso   1.00
C3113  C     0.48597   0.50028  -0.44288   0.00000  Uiso   1.00
H3114  H     0.48880   0.50612  -0.42595   0.00000  Uiso   1.00
H3115  H     0.46070   0.50445  -0.43372   0.00000  Uiso   1.00
H3116  H     0.46574   0.49034  -0.43820   0.00000  Uiso   1.00
H3117  H     0.47083   0.48024  -0.44983   0.00000  Uiso   1.00
H3118  H     0.49547   0.49581  -0.45238   0.00000  Uiso   1.00
H3119  H     0.49031   0.50588  -0.44093   0.00000  Uiso   1.00
C3120  C     0.43162   0.53753  -0.39799   0.00000  Uiso   1.00
C3121  C     0.43370   0.53158  -0.40487   0.00000  Uiso   1.00
C3122  C     0.44244   0.52900  -0.40633   0.00000  Uiso   1.00
C3123  C     0.44938   0.53242  -0.40077   0.00000  Uiso   1.00
C3124  C     0.44713   0.53849  -0.39377   0.00000  Uiso   1.00
C3125  C     0.43833   0.54095  -0.39247   0.00000  Uiso   1.00
C3126  C     0.45812   0.52989  -0.40215   0.00000  Uiso   1.00
N3127  N     0.46435   0.53338  -0.39665   0.00000  Uiso   1.00
C3128  C     0.47278   0.53067  -0.39833   0.00000  Uiso   1.00
N3129  N     0.47520   0.52494  -0.40485   0.00000  Uiso   1.00
C3130  C     0.46840   0.52188  -0.40991   0.00000  Uiso   1.00
N3131  N     0.45974   0.52411  -0.40888   0.00000  Uiso   1.00
H3132  H     0.44391   0.52433  -0.41177   0.00000  Uiso   1.00
H3133  H     0.45228   0.54126  -0.38935   0.00000  Uiso   1.00
H3134  H     0.42834   0.52896  -0.40915   0.00000  Uiso   1.00
H3135  H     0.43658   0.54561  -0.38709   0.00000  Uiso   1.00
C3136  C     0.49307   0.54088  -0.38213   0.00000  Uiso   1.00
C3137  C     0.48422   0.54345  -0.38062   0.00000  Uiso   1.00
C3138  C     0.47744   0.54012  -0.38591   0.00000  Uiso   1.00
C3139  C     0.47947   0.53403  -0.39295   0.00000  Uiso   1.00
C3140  C     0.48853   0.53148  -0.39438   0.00000  Uiso   1.00
C3141  C     0.49519   0.53492  -0.38899   0.00000  Uiso   1.00
H3142  H     0.47054   0.54224  -0.38461   0.00000  Uiso   1.00
H3143  H     0.49036   0.52681  -0.39973   0.00000  Uiso   1.00
H3144  H     0.48268   0.54814  -0.37519   0.00000  Uiso   1.00
H3145  H     0.50217   0.53297  -0.39009   0.00000  Uiso   1.00
C3146  C     0.47110   0.44558  -0.47306   0.00000  Uiso   1.00
C3147  C     0.47972   0.44674  -0.47644   0.00000  Uiso   1.00
C3148  C     0.48460   0.45428  -0.47431   0.00000  Uiso   1.00
C3149  C     0.48089   0.46081  -0.46845   0.00000  Uiso   1.00
C3150  C     0.47207   0.45952  -0.46507   0.00000  Uiso   1.00
C3151  C     0.46730   0.45198  -0.46743   0.00000  Uiso   1.00
H3152  H     0.49136   0.45504  -0.47705   0.00000  Uiso   1.00
H3153  H     0.46898   0.46442  -0.46058   0.00000  Uiso   1.00
H3154  H     0.48263   0.44161  -0.48078   0.00000  Uiso   1.00
H3155  H     0.46051   0.45096  -0.46486   0.00000  Uiso   1.00
C3156  C     0.48701   0.48100  -0.45796   0.00000  Uiso   1.00
N3157  N     0.49530   0.48258  -0.46107   0.00000  Uiso   1.00
C3158  C     0.49848   0.47644  -0.46685   0.00000  Uiso   1.00
N3159  N     0.49404   0.46910  -0.46955   0.00000  Uiso   1.00
C3160  C     0.48579   0.46820  -0.46598   0.00000  Uiso   1.00
N3161  N     0.48192   0.47393  -0.46018   0.00000  Uiso   1.00
C3162  C     0.52398   0.48206  -0.47739   0.00000  Uiso   1.00
C3163  C     0.51991   0.48759  -0.47076   0.00000  Uiso   1.00
C3164  C     0.51169   0.48572  -0.46735   0.00000  Uiso   1.00
C3165  C     0.50692   0.47802  -0.47024   0.00000  Uiso   1.00
C3166  C     0.51093   0.47226  -0.47669   0.00000  Uiso   1.00
C3167  C     0.51918   0.47424  -0.48011   0.00000  Uiso   1.00
H3168  H     0.50886   0.49029  -0.46237   0.00000  Uiso   1.00
H3169  H     0.50740   0.46630  -0.47908   0.00000  Uiso   1.00
H3170  H     0.52336   0.49358  -0.46829   0.00000  Uiso   1.00
H3171  H     0.52200   0.46982  -0.48524   0.00000  Uiso   1.00
H3172  H     0.42465   0.53953  -0.39689   0.00000  Uiso   1.00
H3173  H     0.49841   0.54358  -0.37789   0.00000  Uiso   1.00
H3174  H     0.46728   0.43958  -0.47483   0.00000  Uiso   1.00
C3175  C     0.67796   0.54068  -0.59284   0.00000  Uiso   1.00
C3176  C     0.67955   0.53438  -0.58583   0.00000  Uiso   1.00
C3177  C     0.67922   0.52539  -0.58731   0.00000  Uiso   1.00
C3178  C     0.67720   0.52204  -0.59598   0.00000  Uiso   1.00
C3179  C     0.67564   0.52820  -0.60307   0.00000  Uiso   1.00
C3180  C     0.67605   0.53718  -0.60153   0.00000  Uiso   1.00
H3181  H     0.68048   0.52082  -0.58171   0.00000  Uiso   1.00
H3182  H     0.67406   0.52583  -0.60983   0.00000  Uiso   1.00
C3183  C     0.67819   0.55013  -0.59119   0.00000  Uiso   1.00
C3184  C     0.68149   0.55628  -0.59773   0.00000  Uiso   1.00
C3185  C     0.68181   0.56526  -0.59611   0.00000  Uiso   1.00
C3186  C     0.67876   0.56873  -0.58779   0.00000  Uiso   1.00
C3187  C     0.67539   0.56273  -0.58122   0.00000  Uiso   1.00
C3188  C     0.67515   0.55377  -0.58289   0.00000  Uiso   1.00
H3189  H     0.68114   0.53676  -0.57907   0.00000  Uiso   1.00
H3190  H     0.67470   0.54176  -0.60711   0.00000  Uiso   1.00
H3191  H     0.68397   0.55379  -0.60417   0.00000  Uiso   1.00
H3192  H     0.68446   0.56971  -0.60130   0.00000  Uiso   1.00
H3193  H     0.67297   0.56519  -0.57475   0.00000  Uiso   1.00
H3194  H     0.67246   0.54932  -0.57771   0.00000  Uiso   1.00
C3195  C     0.66736   0.49200  -0.63229   0.00000  Uiso   1.00
C3196  C     0.66816   0.50117  -0.63077   0.00000  Uiso   1.00
C3197  C     0.67042   0.50432  -0.62240   0.00000  Uiso   1.00
C3198  C     0.67196   0.49820  -0.61527   0.00000  Uiso   1.00
C3199  C     0.67116   0.48886  -0.61695   0.00000  Uiso   1.00
C3200  C     0.66884   0.48590  -0.62538   0.00000  Uiso   1.00
C3201  C     0.67412   0.50130  -0.60686   0.00000  Uiso   1.00
N3202  N     0.67554   0.49520  -0.60038   0.00000  Uiso   1.00
C3203  C     0.67757   0.49870  -0.59233   0.00000  Uiso   1.00
N3204  N     0.67820   0.50750  -0.59047   0.00000  Uiso   1.00
C3205  C     0.67667   0.51295  -0.59747   0.00000  Uiso   1.00
N3206  N     0.67462   0.51024  -0.60581   0.00000  Uiso   1.00
H3207  H     0.67097   0.51156  -0.62137   0.00000  Uiso   1.00
H3208  H     0.67227   0.48393  -0.61163   0.00000  Uiso   1.00
H3209  H     0.66698   0.50588  -0.63627   0.00000  Uiso   1.00
H3210  H     0.66814   0.47873  -0.62669   0.00000  Uiso   1.00
C3211  C     0.68240   0.48097  -0.57131   0.00000  Uiso   1.00
C3212  C     0.68033   0.47766  -0.57979   0.00000  Uiso   1.00
C3213  C     0.67868   0.48342  -0.58681   0.00000  Uiso   1.00
C3214  C     0.67912   0.49283  -0.58539   0.00000  Uiso   1.00
C3215  C     0.68126   0.49610  -0.57670   0.00000  Uiso   1.00
C3216  C     0.68285   0.49017  -0.56981   0.00000  Uiso   1.00
H3217  H     0.67707   0.48064  -0.59339   0.00000  Uiso   1.00
H3218  H     0.68167   0.50329  -0.57535   0.00000  Uiso   1.00
H3219  H     0.68004   0.47042  -0.58087   0.00000  Uiso   1.00
H3220  H     0.68449   0.49268  -0.56312   0.00000  Uiso   1.00
C3221  C     0.69221   0.60959  -0.60970   0.00000  Uiso   1.00
C3222  C     0.68932   0.61288  -0.60145   0.00000  Uiso   1.00
C3223  C     0.68613   0.60712  -0.59499   0.00000  Uiso   1.00
C3224  C     0.68578   0.59776  -0.59674   0.00000  Uiso   1.00
C3225  C     0.68878   0.59452  -0.60519   0.00000  Uiso   1.00
C3226  C     0.69193   0.60044  -0.61153   0.00000  Uiso   1.00
H3227  H     0.68388   0.60986  -0.58858   0.00000  Uiso   1.00
H3228  H     0.68860   0.58737  -0.60678   0.00000  Uiso   1.00
H3229  H     0.68958   0.62009  -0.60013   0.00000  Uiso   1.00
H3230  H     0.69423   0.59796  -0.61803   0.00000  Uiso   1.00
C3231  C     0.67912   0.57780  -0.58605   0.00000  Uiso   1.00
N3232  N     0.67614   0.58055  -0.57802   0.00000  Uiso   1.00
C3233  C     0.67666   0.58944  -0.57663   0.00000  Uiso   1.00
N3234  N     0.67981   0.59544  -0.58255   0.00000  Uiso   1.00
C3235  C     0.68256   0.59192  -0.59037   0.00000  Uiso   1.00
N3236  N     0.68239   0.58316  -0.59250   0.00000  Uiso   1.00
C3237  C     0.66615   0.59914  -0.55243   0.00000  Uiso   1.00
C3238  C     0.66624   0.58979  -0.55442   0.00000  Uiso   1.00
C3239  C     0.66986   0.58660  -0.56215   0.00000  Uiso   1.00
C3240  C     0.67359   0.59261  -0.56852   0.00000  Uiso   1.00
C3241  C     0.67380   0.60193  -0.56657   0.00000  Uiso   1.00
C3242  C     0.67027   0.60504  -0.55875   0.00000  Uiso   1.00
H3243  H     0.66964   0.57939  -0.56345   0.00000  Uiso   1.00
H3244  H     0.67664   0.60671  -0.57134   0.00000  Uiso   1.00
H3245  H     0.66320   0.58504  -0.54972   0.00000  Uiso   1.00
H3246  H     0.67026   0.61228  -0.55753   0.00000  Uiso   1.00
H3247  H     0.66554   0.48956  -0.63896   0.00000  Uiso   1.00
H3248  H     0.68369   0.47631  -0.56580   0.00000  Uiso   1.00
H3249  H     0.69473   0.61423  -0.61478   0.00000  Uiso   1.00
C3250  C     0.45965   0.64588  -0.50852   0.00000  Uiso   1.00
C3251  C     0.46248   0.65502  -0.50825   0.00000  Uiso   1.00
C3252  C     0.45875   0.66134  -0.51367   0.00000  Uiso   1.00
C3253  C     0.45193   0.65892  -0.51985   0.00000  Uiso   1.00
C3254  C     0.44910   0.64984  -0.52031   0.00000  Uiso   1.00
C3255  C     0.45281   0.64360  -0.51481   0.00000  Uiso   1.00
H3256  H     0.46108   0.66827  -0.51317   0.00000  Uiso   1.00
H3257  H     0.44389   0.64776  -0.52503   0.00000  Uiso   1.00
C3258  C     0.46354   0.63924  -0.50280   0.00000  Uiso   1.00
C3259  C     0.45828   0.63208  -0.49927   0.00000  Uiso   1.00
C3260  C     0.46201   0.62544  -0.49427   0.00000  Uiso   1.00
C3261  C     0.47137   0.62544  -0.49252   0.00000  Uiso   1.00
C3262  C     0.47668   0.63264  -0.49575   0.00000  Uiso   1.00
C3263  C     0.47286   0.63931  -0.50067   0.00000  Uiso   1.00
H3264  H     0.46768   0.65708  -0.50350   0.00000  Uiso   1.00
H3265  H     0.45052   0.63664  -0.51536   0.00000  Uiso   1.00
H3266  H     0.45108   0.63181  -0.50065   0.00000  Uiso   1.00
H3267  H     0.45772   0.62000  -0.49187   0.00000  Uiso   1.00
H3268  H     0.48391   0.63284  -0.49451   0.00000  Uiso   1.00
H3269  H     0.47717   0.64464  -0.50329   0.00000  Uiso   1.00
C3270  C     0.41847   0.66128  -0.55446   0.00000  Uiso   1.00
C3271  C     0.42232   0.65488  -0.54887   0.00000  Uiso   1.00
C3272  C     0.42887   0.65730  -0.54283   0.00000  Uiso   1.00
C3273  C     0.43170   0.66638  -0.54230   0.00000  Uiso   1.00
C3274  C     0.42770   0.67282  -0.54807   0.00000  Uiso   1.00
C3275  C     0.42118   0.67020  -0.55405   0.00000  Uiso   1.00
C3276  C     0.43823   0.66889  -0.53629   0.00000  Uiso   1.00
N3277  N     0.44059   0.67758  -0.53613   0.00000  Uiso   1.00
C3278  C     0.44700   0.67961  -0.53014   0.00000  Uiso   1.00
N3279  N     0.45101   0.67374  -0.52459   0.00000  Uiso   1.00
C3280  C     0.44810   0.66526  -0.52536   0.00000  Uiso   1.00
N3281  N     0.44173   0.66244  -0.53107   0.00000  Uiso   1.00
H3282  H     0.43180   0.65216  -0.53851   0.00000  Uiso   1.00
H3283  H     0.42972   0.67986  -0.54787   0.00000  Uiso   1.00
H3284  H     0.42013   0.64789  -0.54928   0.00000  Uiso   1.00
H3285  H     0.41809   0.67514  -0.55850   0.00000  Uiso   1.00
C3286  C     0.45510   0.70627  -0.52862   0.00000  Uiso   1.00
C3287  C     0.44848   0.70379  -0.53472   0.00000  Uiso   1.00
C3288  C     0.44574   0.69499  -0.53530   0.00000  Uiso   1.00
C3289  C     0.44969   0.68842  -0.52965   0.00000  Uiso   1.00
C3290  C     0.45644   0.69106  -0.52349   0.00000  Uiso   1.00
C3291  C     0.45905   0.69991  -0.52305   0.00000  Uiso   1.00
H3292  H     0.44052   0.69321  -0.54013   0.00000  Uiso   1.00
H3293  H     0.45964   0.68619  -0.51904   0.00000  Uiso   1.00
H3294  H     0.44545   0.70887  -0.53905   0.00000  Uiso   1.00
H3295  H     0.46424   0.70196  -0.51830   0.00000  Uiso   1.00
C3296  C     0.45858   0.58213  -0.47602   0.00000  Uiso   1.00
C3297  C     0.46767   0.58216  -0.47390   0.00000  Uiso   1.00
C3298  C     0.47276   0.58974  -0.47531   0.00000  Uiso   1.00
C3299  C     0.46874   0.59750  -0.47909   0.00000  Uiso   1.00
C3300  C     0.45940   0.59744  -0.48096   0.00000  Uiso   1.00
C3301  C     0.45448   0.58976  -0.47950   0.00000  Uiso   1.00
H3302  H     0.47992   0.58954  -0.47379   0.00000  Uiso   1.00
H3303  H     0.45608   0.60328  -0.48387   0.00000  Uiso   1.00
H3304  H     0.47078   0.57613  -0.47112   0.00000  Uiso   1.00
H3305  H     0.44732   0.58964  -0.48107   0.00000  Uiso   1.00
C3306  C     0.47526   0.61832  -0.48810   0.00000  Uiso   1.00
N3307  N     0.48420   0.61848  -0.48698   0.00000  Uiso   1.00
C3308  C     0.48758   0.61121  -0.48287   0.00000  Uiso   1.00
N3309  N     0.48280   0.60416  -0.47997   0.00000  Uiso   1.00
C3310  C     0.47394   0.60472  -0.48151   0.00000  Uiso   1.00
N3311  N     0.46980   0.61164  -0.48552   0.00000  Uiso   1.00
C3312  C     0.51552   0.60828  -0.48262   0.00000  Uiso   1.00
C3313  C     0.51142   0.61633  -0.48575   0.00000  Uiso   1.00
C3314  C     0.50238   0.61754  -0.48545   0.00000  Uiso   1.00
C3315  C     0.49676   0.61074  -0.48189   0.00000  Uiso   1.00
C3316  C     0.50078   0.60300  -0.47810   0.00000  Uiso   1.00
C3317  C     0.50982   0.60189  -0.47843   0.00000  Uiso   1.00
H3318  H     0.49951   0.62360  -0.48844   0.00000  Uiso   1.00
H3319  H     0.49666   0.59763  -0.47525   0.00000  Uiso   1.00
H3320  H     0.51544   0.62145  -0.48914   0.00000  Uiso   1.00
H3321  H     0.51260   0.59562  -0.47582   0.00000  Uiso   1.00
H3322  H     0.41328   0.65927  -0.55923   0.00000  Uiso   1.00
H3323  H     0.45722   0.71327  -0.52821   0.00000  Uiso   1.00
H3324  H     0.45462   0.57606  -0.47491   0.00000  Uiso   1.00
C3325  C     0.49454   0.60135  -0.38693   0.00000  Uiso   1.00
C3326  C     0.50389   0.60209  -0.38509   0.00000  Uiso   1.00
C3327  C     0.50757   0.59849  -0.37756   0.00000  Uiso   1.00
C3328  C     0.50208   0.59392  -0.37127   0.00000  Uiso   1.00
C3329  C     0.49275   0.59317  -0.37294   0.00000  Uiso   1.00
C3330  C     0.48915   0.59673  -0.38052   0.00000  Uiso   1.00
H3331  H     0.51478   0.59919  -0.37645   0.00000  Uiso   1.00
H3332  H     0.48834   0.58970  -0.36821   0.00000  Uiso   1.00
C3333  C     0.49066   0.60516  -0.39484   0.00000  Uiso   1.00
C3334  C     0.48330   0.60098  -0.39927   0.00000  Uiso   1.00
C3335  C     0.47930   0.60477  -0.40652   0.00000  Uiso   1.00
C3336  C     0.48236   0.61315  -0.40984   0.00000  Uiso   1.00
C3337  C     0.48982   0.61733  -0.40567   0.00000  Uiso   1.00
C3338  C     0.49382   0.61344  -0.39845   0.00000  Uiso   1.00
H3339  H     0.50829   0.60554  -0.38984   0.00000  Uiso   1.00
H3340  H     0.48192   0.59610  -0.38158   0.00000  Uiso   1.00
H3341  H     0.48070   0.59457  -0.39679   0.00000  Uiso   1.00
H3342  H     0.47356   0.60138  -0.40959   0.00000  Uiso   1.00
H3343  H     0.49234   0.62379  -0.40806   0.00000  Uiso   1.00
H3344  H     0.49941   0.61694  -0.39523   0.00000  Uiso   1.00
C3345  C     0.48762   0.56976  -0.33211   0.00000  Uiso   1.00
C3346  C     0.48390   0.57338  -0.33988   0.00000  Uiso   1.00
C3347  C     0.48927   0.57762  -0.34607   0.00000  Uiso   1.00
C3348  C     0.49864   0.57833  -0.34453   0.00000  Uiso   1.00
C3349  C     0.50232   0.57458  -0.33659   0.00000  Uiso   1.00
C3350  C     0.49680   0.57038  -0.33051   0.00000  Uiso   1.00
C3351  C     0.50406   0.58264  -0.35062   0.00000  Uiso   1.00
N3352  N     0.51286   0.58306  -0.34874   0.00000  Uiso   1.00
C3353  C     0.51782   0.58736  -0.35491   0.00000  Uiso   1.00
N3354  N     0.51464   0.59110  -0.36247   0.00000  Uiso   1.00
C3355  C     0.50576   0.59024  -0.36363   0.00000  Uiso   1.00
N3356  N     0.50014   0.58608  -0.35795   0.00000  Uiso   1.00
H3357  H     0.48620   0.58042  -0.35211   0.00000  Uiso   1.00
H3358  H     0.50950   0.57500  -0.33517   0.00000  Uiso   1.00
H3359  H     0.47669   0.57283  -0.34105   0.00000  Uiso   1.00
H3360  H     0.49961   0.56750  -0.32437   0.00000  Uiso   1.00
C3361  C     0.54526   0.58914  -0.35021   0.00000  Uiso   1.00
C3362  C     0.53978   0.58476  -0.34405   0.00000  Uiso   1.00
C3363  C     0.53070   0.58413  -0.34551   0.00000  Uiso   1.00
C3364  C     0.52688   0.58796  -0.35335   0.00000  Uiso   1.00
C3365  C     0.53256   0.59240  -0.35957   0.00000  Uiso   1.00
C3366  C     0.54163   0.59293  -0.35793   0.00000  Uiso   1.00
H3367  H     0.52654   0.58066  -0.34057   0.00000  Uiso   1.00
H3368  H     0.52987   0.59541  -0.36569   0.00000  Uiso   1.00
H3369  H     0.54274   0.58182  -0.33802   0.00000  Uiso   1.00
H3370  H     0.54602   0.59634  -0.36271   0.00000  Uiso   1.00
C3371  C     0.44352   0.60607  -0.43755   0.00000  Uiso   1.00
C3372  C     0.44630   0.61448  -0.44050   0.00000  Uiso   1.00
C3373  C     0.45400   0.61829  -0.43713   0.00000  Uiso   1.00
C3374  C     0.45904   0.61371  -0.43047   0.00000  Uiso   1.00
C3375  C     0.45612   0.60512  -0.42756   0.00000  Uiso   1.00
C3376  C     0.44844   0.60142  -0.43112   0.00000  Uiso   1.00
H3377  H     0.45604   0.62490  -0.43955   0.00000  Uiso   1.00
H3378  H     0.45982   0.60139  -0.42245   0.00000  Uiso   1.00
H3379  H     0.44238   0.61802  -0.44559   0.00000  Uiso   1.00
H3380  H     0.44618   0.59482  -0.42889   0.00000  Uiso   1.00
C3381  C     0.47790   0.61735  -0.41675   0.00000  Uiso   1.00
N3382  N     0.48092   0.62542  -0.41933   0.00000  Uiso   1.00
C3383  C     0.47614   0.62931  -0.42591   0.00000  Uiso   1.00
N3384  N     0.46886   0.62576  -0.42985   0.00000  Uiso   1.00
C3385  C     0.46650   0.61764  -0.42675   0.00000  Uiso   1.00
N3386  N     0.47076   0.61310  -0.42023   0.00000  Uiso   1.00
C3387  C     0.48444   0.65477  -0.43458   0.00000  Uiso   1.00
C3388  C     0.48906   0.65012  -0.42761   0.00000  Uiso   1.00
C3389  C     0.48645   0.64184  -0.42483   0.00000  Uiso   1.00
C3390  C     0.47888   0.63764  -0.42879   0.00000  Uiso   1.00
C3391  C     0.47412   0.64219  -0.43567   0.00000  Uiso   1.00
C3392  C     0.47678   0.65048  -0.43841   0.00000  Uiso   1.00
H3393  H     0.49024   0.63853  -0.41949   0.00000  Uiso   1.00
H3394  H     0.46825   0.63913  -0.43883   0.00000  Uiso   1.00
H3395  H     0.49486   0.65326  -0.42439   0.00000  Uiso   1.00
H3396  H     0.47308   0.65378  -0.44381   0.00000  Uiso   1.00
H3397  H     0.48330   0.56642  -0.32724   0.00000  Uiso   1.00
H3398  H     0.55246   0.58961  -0.34897   0.00000  Uiso   1.00
H3399  H     0.43743   0.60308  -0.44033   0.00000  Uiso   1.00
C3400  C     0.60088   0.59975  -0.30667   0.00000  Uiso   1.00
C3401  C     0.59202   0.59884  -0.31016   0.00000  Uiso   1.00
C3402  C     0.58762   0.59086  -0.31000   0.00000  Uiso   1.00
C3403  C     0.59181   0.58316  -0.30631   0.00000  Uiso   1.00
C3404  C     0.60059   0.58393  -0.30273   0.00000  Uiso   1.00
C3405  C     0.60493   0.59195  -0.30290   0.00000  Uiso   1.00
H3406  H     0.58084   0.59050  -0.31279   0.00000  Uiso   1.00
H3407  H     0.60400   0.57811  -0.29984   0.00000  Uiso   1.00
C3408  C     0.60554   0.60813  -0.30707   0.00000  Uiso   1.00
C3409  C     0.61164   0.61079  -0.30021   0.00000  Uiso   1.00
C3410  C     0.61602   0.61878  -0.30055   0.00000  Uiso   1.00
C3411  C     0.61464   0.62469  -0.30788   0.00000  Uiso   1.00
C3412  C     0.60862   0.62215  -0.31481   0.00000  Uiso   1.00
C3413  C     0.60424   0.61416  -0.31437   0.00000  Uiso   1.00
H3414  H     0.58860   0.60466  -0.31303   0.00000  Uiso   1.00
H3415  H     0.61175   0.59230  -0.30022   0.00000  Uiso   1.00
H3416  H     0.61279   0.60642  -0.29443   0.00000  Uiso   1.00
H3417  H     0.62061   0.62055  -0.29511   0.00000  Uiso   1.00
H3418  H     0.60742   0.62654  -0.32055   0.00000  Uiso   1.00
H3419  H     0.59971   0.61237  -0.31985   0.00000  Uiso   1.00
C3420  C     0.59978   0.53778  -0.29216   0.00000  Uiso   1.00
C3421  C     0.60419   0.54602  -0.29215   0.00000  Uiso   1.00
C3422  C     0.60010   0.55349  -0.29569   0.00000  Uiso   1.00
C3423  C     0.59134   0.55282  -0.29937   0.00000  Uiso   1.00
C3424  C     0.58695   0.54436  -0.29933   0.00000  Uiso   1.00
C3425  C     0.59120   0.53700  -0.29575   0.00000  Uiso   1.00
C3426  C     0.58720   0.56024  -0.30291   0.00000  Uiso   1.00
N3427  N     0.57892   0.55917  -0.30628   0.00000  Uiso   1.00
C3428  C     0.57524   0.56667  -0.30965   0.00000  Uiso   1.00
N3429  N     0.57916   0.57478  -0.30983   0.00000  Uiso   1.00
C3430  C     0.58743   0.57503  -0.30627   0.00000  Uiso   1.00
N3431  N     0.59178   0.56800  -0.30272   0.00000  Uiso   1.00
H3432  H     0.60369   0.55988  -0.29559   0.00000  Uiso   1.00
H3433  H     0.58022   0.54358  -0.30211   0.00000  Uiso   1.00
H3434  H     0.61093   0.54652  -0.28930   0.00000  Uiso   1.00
H3435  H     0.58784   0.53048  -0.29571   0.00000  Uiso   1.00
C3436  C     0.54957   0.56474  -0.32042   0.00000  Uiso   1.00
C3437  C     0.55366   0.55714  -0.31684   0.00000  Uiso   1.00
C3438  C     0.56215   0.55768  -0.31325   0.00000  Uiso   1.00
C3439  C     0.56676   0.56602  -0.31321   0.00000  Uiso   1.00
C3440  C     0.56248   0.57368  -0.31689   0.00000  Uiso   1.00
C3441  C     0.55398   0.57296  -0.32043   0.00000  Uiso   1.00
H3442  H     0.56523   0.55164  -0.31048   0.00000  Uiso   1.00
H3443  H     0.56582   0.58021  -0.31698   0.00000  Uiso   1.00
H3444  H     0.55009   0.55074  -0.31688   0.00000  Uiso   1.00
H3445  H     0.55068   0.57886  -0.32326   0.00000  Uiso   1.00
C3446  C     0.64648   0.65000  -0.28199   0.00000  Uiso   1.00
C3447  C     0.64515   0.65575  -0.28923   0.00000  Uiso   1.00
C3448  C     0.63932   0.65344  -0.29600   0.00000  Uiso   1.00
C3449  C     0.63465   0.64514  -0.29561   0.00000  Uiso   1.00
C3450  C     0.63609   0.63937  -0.28817   0.00000  Uiso   1.00
C3451  C     0.64196   0.64186  -0.28149   0.00000  Uiso   1.00
H3452  H     0.63839   0.65805  -0.30162   0.00000  Uiso   1.00
H3453  H     0.63262   0.63294  -0.28764   0.00000  Uiso   1.00
H3454  H     0.64876   0.66212  -0.28951   0.00000  Uiso   1.00
H3455  H     0.64308   0.63742  -0.27576   0.00000  Uiso   1.00
C3456  C     0.61909   0.63276  -0.30831   0.00000  Uiso   1.00
N3457  N     0.61750   0.63798  -0.31548   0.00000  Uiso   1.00
C3458  C     0.62206   0.64575  -0.31557   0.00000  Uiso   1.00
N3459  N     0.62780   0.64849  -0.30920   0.00000  Uiso   1.00
C3460  C     0.62884   0.64273  -0.30235   0.00000  Uiso   1.00
N3461  N     0.62468   0.63478  -0.30154   0.00000  Uiso   1.00
C3462  C     0.61844   0.66252  -0.33789   0.00000  Uiso   1.00
C3463  C     0.61373   0.65424  -0.33707   0.00000  Uiso   1.00
C3464  C     0.61484   0.64882  -0.32983   0.00000  Uiso   1.00
C3465  C     0.62076   0.65133  -0.32281   0.00000  Uiso   1.00
C3466  C     0.62541   0.65961  -0.32343   0.00000  Uiso   1.00
C3467  C     0.62428   0.66497  -0.33073   0.00000  Uiso   1.00
H3468  H     0.61116   0.64248  -0.32955   0.00000  Uiso   1.00
H3469  H     0.63000   0.66175  -0.31813   0.00000  Uiso   1.00
H3470  H     0.60925   0.65202  -0.34243   0.00000  Uiso   1.00
H3471  H     0.62798   0.67130  -0.33101   0.00000  Uiso   1.00
H3472  H     0.60310   0.53189  -0.28933   0.00000  Uiso   1.00
H3473  H     0.54282   0.56424  -0.32325   0.00000  Uiso   1.00
H3474  H     0.65112   0.65191  -0.27665   0.00000  Uiso   1.00
C3475  C     0.60630   0.66343  -0.47061   0.00000  Uiso   1.00
C3476  C     0.60942   0.66358  -0.46157   0.00000  Uiso   1.00
C3477  C     0.61588   0.65785  -0.45865   0.00000  Uiso   1.00
C3478  C     0.61966   0.65146  -0.46462   0.00000  Uiso   1.00
C3479  C     0.61667   0.65122  -0.47365   0.00000  Uiso   1.00
C3480  C     0.61025   0.65702  -0.47651   0.00000  Uiso   1.00
H3481  H     0.61805   0.65822  -0.45166   0.00000  Uiso   1.00
H3482  H     0.61946   0.64638  -0.47840   0.00000  Uiso   1.00
C3483  C     0.59946   0.66944  -0.47360   0.00000  Uiso   1.00
C3484  C     0.59950   0.67301  -0.48247   0.00000  Uiso   1.00
C3485  C     0.59300   0.67872  -0.48535   0.00000  Uiso   1.00
C3486  C     0.58588   0.68119  -0.47953   0.00000  Uiso   1.00
C3487  C     0.58572   0.67772  -0.47067   0.00000  Uiso   1.00
C3488  C     0.59230   0.67208  -0.46783   0.00000  Uiso   1.00
H3489  H     0.60665   0.66845  -0.45683   0.00000  Uiso   1.00
H3490  H     0.60801   0.65660  -0.48349   0.00000  Uiso   1.00
H3491  H     0.60492   0.67125  -0.48710   0.00000  Uiso   1.00
H3492  H     0.59332   0.68128  -0.49221   0.00000  Uiso   1.00
H3493  H     0.58032   0.67950  -0.46603   0.00000  Uiso   1.00
H3494  H     0.59194   0.66944  -0.46100   0.00000  Uiso   1.00
C3495  C     0.64604   0.61465  -0.48139   0.00000  Uiso   1.00
C3496  C     0.63940   0.62045  -0.48446   0.00000  Uiso   1.00
C3497  C     0.63598   0.62700  -0.47892   0.00000  Uiso   1.00
C3498  C     0.63914   0.62774  -0.46997   0.00000  Uiso   1.00
C3499  C     0.64589   0.62174  -0.46693   0.00000  Uiso   1.00
C3500  C     0.64926   0.61533  -0.47265   0.00000  Uiso   1.00
C3501  C     0.63562   0.63406  -0.46427   0.00000  Uiso   1.00
N3502  N     0.63871   0.63414  -0.45581   0.00000  Uiso   1.00
C3503  C     0.63495   0.64036  -0.45049   0.00000  Uiso   1.00
N3504  N     0.62863   0.64624  -0.45303   0.00000  Uiso   1.00
C3505  C     0.62611   0.64557  -0.46165   0.00000  Uiso   1.00
N3506  N     0.62933   0.63960  -0.46757   0.00000  Uiso   1.00
H3507  H     0.63077   0.63146  -0.48149   0.00000  Uiso   1.00
H3508  H     0.64848   0.62210  -0.46009   0.00000  Uiso   1.00
H3509  H     0.63690   0.61977  -0.49132   0.00000  Uiso   1.00
H3510  H     0.65447   0.61072  -0.47034   0.00000  Uiso   1.00
C3511  C     0.64332   0.64120  -0.42389   0.00000  Uiso   1.00
C3512  C     0.64707   0.63494  -0.42972   0.00000  Uiso   1.00
C3513  C     0.64439   0.63462  -0.43855   0.00000  Uiso   1.00
C3514  C     0.63777   0.64068  -0.44172   0.00000  Uiso   1.00
C3515  C     0.63404   0.64703  -0.43568   0.00000  Uiso   1.00
C3516  C     0.63684   0.64721  -0.42689   0.00000  Uiso   1.00
H3517  H     0.64740   0.62963  -0.44299   0.00000  Uiso   1.00
H3518  H     0.62892   0.65180  -0.43788   0.00000  Uiso   1.00
H3519  H     0.65215   0.63027  -0.42725   0.00000  Uiso   1.00
H3520  H     0.63396   0.65208  -0.42223   0.00000  Uiso   1.00
C3521  C     0.57398   0.70469  -0.51978   0.00000  Uiso   1.00
C3522  C     0.56677   0.70696  -0.51429   0.00000  Uiso   1.00
C3523  C     0.56636   0.70385  -0.50561   0.00000  Uiso   1.00
C3524  C     0.57330   0.69826  -0.50224   0.00000  Uiso   1.00
C3525  C     0.58059   0.69600  -0.50794   0.00000  Uiso   1.00
C3526  C     0.58086   0.69925  -0.51657   0.00000  Uiso   1.00
H3527  H     0.56064   0.70572  -0.50143   0.00000  Uiso   1.00
H3528  H     0.58606   0.69173  -0.50559   0.00000  Uiso   1.00
H3529  H     0.56143   0.71124  -0.51691   0.00000  Uiso   1.00
H3530  H     0.58651   0.69757  -0.52093   0.00000  Uiso   1.00
C3531  C     0.57915   0.68676  -0.48250   0.00000  Uiso   1.00
N3532  N     0.57249   0.68872  -0.47675   0.00000  Uiso   1.00
C3533  C     0.56609   0.69411  -0.48011   0.00000  Uiso   1.00
N3534  N     0.56598   0.69748  -0.48847   0.00000  Uiso   1.00
C3535  C     0.57300   0.69508  -0.49359   0.00000  Uiso   1.00
N3536  N     0.57976   0.68974  -0.49097   0.00000  Uiso   1.00
C3537  C     0.54365   0.69927  -0.46389   0.00000  Uiso   1.00
C3538  C     0.55105   0.69418  -0.46065   0.00000  Uiso   1.00
C3539  C     0.55844   0.69266  -0.46579   0.00000  Uiso   1.00
C3540  C     0.55898   0.69622  -0.47460   0.00000  Uiso   1.00
C3541  C     0.55186   0.70166  -0.47781   0.00000  Uiso   1.00
C3542  C     0.54453   0.70316  -0.47259   0.00000  Uiso   1.00
H3543  H     0.56382   0.68847  -0.46309   0.00000  Uiso   1.00
H3544  H     0.55205   0.70451  -0.48456   0.00000  Uiso   1.00
H3545  H     0.55071   0.69106  -0.45402   0.00000  Uiso   1.00
H3546  H     0.53897   0.70698  -0.47549   0.00000  Uiso   1.00
H3547  H     0.64872   0.60952  -0.48587   0.00000  Uiso   1.00
H3548  H     0.64550   0.64140  -0.41689   0.00000  Uiso   1.00
H3549  H     0.57426   0.70721  -0.52665   0.00000  Uiso   1.00
C3550  C     0.72204   0.70128  -0.40871   0.00000  Uiso   1.00
C3551  C     0.72536   0.69786  -0.40041   0.00000  Uiso   1.00
C3552  C     0.73334   0.69350  -0.39991   0.00000  Uiso   1.00
C3553  C     0.73854   0.69212  -0.40777   0.00000  Uiso   1.00
C3554  C     0.73534   0.69544  -0.41611   0.00000  Uiso   1.00
C3555  C     0.72741   0.69992  -0.41651   0.00000  Uiso   1.00
H3556  H     0.73564   0.69103  -0.39341   0.00000  Uiso   1.00
H3557  H     0.73921   0.69450  -0.42226   0.00000  Uiso   1.00
C3558  C     0.71366   0.70588  -0.40918   0.00000  Uiso   1.00
C3559  C     0.71250   0.71357  -0.41476   0.00000  Uiso   1.00
C3560  C     0.70455   0.71800  -0.41518   0.00000  Uiso   1.00
C3561  C     0.69709   0.71494  -0.41011   0.00000  Uiso   1.00
C3562  C     0.69808   0.70728  -0.40455   0.00000  Uiso   1.00
C3563  C     0.70610   0.70296  -0.40408   0.00000  Uiso   1.00
H3564  H     0.72148   0.69884  -0.39425   0.00000  Uiso   1.00
H3565  H     0.72508   0.70238  -0.42302   0.00000  Uiso   1.00
H3566  H     0.71816   0.71608  -0.41871   0.00000  Uiso   1.00
H3567  H     0.70399   0.72388  -0.41952   0.00000  Uiso   1.00
H3568  H     0.69245   0.70476  -0.40059   0.00000  Uiso   1.00
H3569  H     0.70667   0.69704  -0.39978   0.00000  Uiso   1.00
C3570  C     0.77342   0.67699  -0.43745   0.00000  Uiso   1.00
C3571  C     0.76512   0.68122  -0.43798   0.00000  Uiso   1.00
C3572  C     0.76030   0.68304  -0.43032   0.00000  Uiso   1.00
C3573  C     0.76376   0.68044  -0.42183   0.00000  Uiso   1.00
C3574  C     0.77220   0.67606  -0.42141   0.00000  Uiso   1.00
C3575  C     0.77693   0.67444  -0.42918   0.00000  Uiso   1.00
C3576  C     0.75892   0.68202  -0.41415   0.00000  Uiso   1.00
N3577  N     0.76238   0.67904  -0.40639   0.00000  Uiso   1.00
C3578  C     0.75728   0.68062  -0.39914   0.00000  Uiso   1.00
N3579  N     0.74933   0.68486  -0.39919   0.00000  Uiso   1.00
C3580  C     0.74660   0.68764  -0.40731   0.00000  Uiso   1.00
N3581  N     0.75108   0.68637  -0.41502   0.00000  Uiso   1.00
H3582  H     0.75380   0.68635  -0.43091   0.00000  Uiso   1.00
H3583  H     0.77507   0.67396  -0.41501   0.00000  Uiso   1.00
H3584  H     0.76242   0.68309  -0.44453   0.00000  Uiso   1.00
H3585  H     0.78345   0.67110  -0.42887   0.00000  Uiso   1.00
C3586  C     0.76673   0.67153  -0.37451   0.00000  Uiso   1.00
C3587  C     0.77181   0.67012  -0.38222   0.00000  Uiso   1.00
C3588  C     0.76877   0.67309  -0.39041   0.00000  Uiso   1.00
C3589  C     0.76041   0.67763  -0.39101   0.00000  Uiso   1.00
C3590  C     0.75532   0.67900  -0.38307   0.00000  Uiso   1.00
C3591  C     0.75852   0.67595  -0.37497   0.00000  Uiso   1.00
H3592  H     0.77286   0.67190  -0.39637   0.00000  Uiso   1.00
H3593  H     0.74886   0.68245  -0.38327   0.00000  Uiso   1.00
H3594  H     0.77824   0.66663  -0.38174   0.00000  Uiso   1.00
H3595  H     0.75462   0.67700  -0.36886   0.00000  Uiso   1.00
C3596  C     0.67786   0.75318  -0.43237   0.00000  Uiso   1.00
C3597  C     0.67048   0.75000  -0.42763   0.00000  Uiso   1.00
C3598  C     0.67124   0.74251  -0.42229   0.00000  Uiso   1.00
C3599  C     0.67960   0.73799  -0.42162   0.00000  Uiso   1.00
C3600  C     0.68706   0.74132  -0.42653   0.00000  Uiso   1.00
C3601  C     0.68610   0.74883  -0.43181   0.00000  Uiso   1.00
H3602  H     0.66535   0.74015  -0.41862   0.00000  Uiso   1.00
H3603  H     0.69359   0.73802  -0.42617   0.00000  Uiso   1.00
H3604  H     0.66405   0.75350  -0.42815   0.00000  Uiso   1.00
H3605  H     0.69184   0.75141  -0.43557   0.00000  Uiso   1.00
C3606  C     0.68898   0.71932  -0.41065   0.00000  Uiso   1.00
N3607  N     0.68214   0.71598  -0.40581   0.00000  Uiso   1.00
C3608  C     0.67438   0.72049  -0.40667   0.00000  Uiso   1.00
N3609  N     0.67314   0.72779  -0.41179   0.00000  Uiso   1.00
C3610  C     0.68046   0.73053  -0.41628   0.00000  Uiso   1.00
N3611  N     0.68854   0.72656  -0.41599   0.00000  Uiso   1.00
C3612  C     0.65186   0.71021  -0.39328   0.00000  Uiso   1.00
C3613  C     0.66047   0.70614  -0.39238   0.00000  Uiso   1.00
C3614  C     0.66782   0.70952  -0.39659   0.00000  Uiso   1.00
C3615  C     0.66708   0.71731  -0.40199   0.00000  Uiso   1.00
C3616  C     0.65863   0.72162  -0.40276   0.00000  Uiso   1.00
C3617  C     0.65132   0.71816  -0.39854   0.00000  Uiso   1.00
H3618  H     0.67424   0.70605  -0.39585   0.00000  Uiso   1.00
H3619  H     0.65783   0.72766  -0.40685   0.00000  Uiso   1.00
H3620  H     0.66123   0.69996  -0.38849   0.00000  Uiso   1.00
H3621  H     0.64488   0.72159  -0.39936   0.00000  Uiso   1.00
H3622  H     0.77720   0.67564  -0.44357   0.00000  Uiso   1.00
H3623  H     0.76921   0.66914  -0.36805   0.00000  Uiso   1.00
H3624  H     0.67718   0.75914  -0.43659   0.00000  Uiso   1.00
C3625  C     0.63504   0.79053  -0.46371   0.00000  Uiso   1.00
C3626  C     0.64388   0.79334  -0.46140   0.00000  Uiso   1.00
C3627  C     0.64668   0.80192  -0.46275   0.00000  Uiso   1.00
C3628  C     0.64078   0.80833  -0.46659   0.00000  Uiso   1.00
C3629  C     0.63194   0.80568  -0.46892   0.00000  Uiso   1.00
C3630  C     0.62920   0.79710  -0.46748   0.00000  Uiso   1.00
H3631  H     0.65352   0.80375  -0.46086   0.00000  Uiso   1.00
H3632  H     0.62725   0.81045  -0.47191   0.00000  Uiso   1.00
C3633  C     0.63218   0.78146  -0.46244   0.00000  Uiso   1.00
C3634  C     0.62319   0.77938  -0.45993   0.00000  Uiso   1.00
C3635  C     0.62038   0.77076  -0.45893   0.00000  Uiso   1.00
C3636  C     0.62640   0.76355  -0.46047   0.00000  Uiso   1.00
C3637  C     0.63539   0.76548  -0.46293   0.00000  Uiso   1.00
C3638  C     0.63816   0.77412  -0.46383   0.00000  Uiso   1.00
H3639  H     0.64858   0.78855  -0.45842   0.00000  Uiso   1.00
H3640  H     0.62238   0.79523  -0.46946   0.00000  Uiso   1.00
H3641  H     0.61839   0.78480  -0.45871   0.00000  Uiso   1.00
H3642  H     0.61341   0.76950  -0.45701   0.00000  Uiso   1.00
H3643  H     0.64019   0.76008  -0.46417   0.00000  Uiso   1.00
H3644  H     0.64509   0.77539  -0.46586   0.00000  Uiso   1.00
C3645  C     0.62355   0.84948  -0.48491   0.00000  Uiso   1.00
C3646  C     0.62064   0.84075  -0.48332   0.00000  Uiso   1.00
C3647  C     0.62631   0.83458  -0.47945   0.00000  Uiso   1.00
C3648  C     0.63517   0.83713  -0.47705   0.00000  Uiso   1.00
C3649  C     0.63802   0.84606  -0.47873   0.00000  Uiso   1.00
C3650  C     0.63222   0.85209  -0.48262   0.00000  Uiso   1.00
C3651  C     0.64089   0.83102  -0.47319   0.00000  Uiso   1.00
N3652  N     0.64918   0.83385  -0.47109   0.00000  Uiso   1.00
C3653  C     0.65446   0.82758  -0.46738   0.00000  Uiso   1.00
N3654  N     0.65206   0.81904  -0.46573   0.00000  Uiso   1.00
C3655  C     0.64362   0.81698  -0.46810   0.00000  Uiso   1.00
N3656  N     0.63774   0.82268  -0.47185   0.00000  Uiso   1.00
H3657  H     0.62388   0.82777  -0.47827   0.00000  Uiso   1.00
H3658  H     0.64480   0.84827  -0.47699   0.00000  Uiso   1.00
H3659  H     0.61382   0.83880  -0.48516   0.00000  Uiso   1.00
H3660  H     0.63439   0.85897  -0.48392   0.00000  Uiso   1.00
C3661  C     0.68041   0.83504  -0.46035   0.00000  Uiso   1.00
C3662  C     0.67468   0.84133  -0.46419   0.00000  Uiso   1.00
C3663  C     0.66608   0.83896  -0.46657   0.00000  Uiso   1.00
C3664  C     0.66303   0.83006  -0.46507   0.00000  Uiso   1.00
C3665  C     0.66898   0.82374  -0.46114   0.00000  Uiso   1.00
C3666  C     0.67754   0.82628  -0.45884   0.00000  Uiso   1.00
H3667  H     0.66170   0.84401  -0.46957   0.00000  Uiso   1.00
H3668  H     0.66687   0.81683  -0.45989   0.00000  Uiso   1.00
H3669  H     0.67704   0.84818  -0.46533   0.00000  Uiso   1.00
H3670  H     0.68212   0.82143  -0.45581   0.00000  Uiso   1.00
C3671  C     0.58620   0.73918  -0.44947   0.00000  Uiso   1.00
C3672  C     0.59212   0.73216  -0.45112   0.00000  Uiso   1.00
C3673  C     0.60087   0.73390  -0.45352   0.00000  Uiso   1.00
C3674  C     0.60386   0.74292  -0.45431   0.00000  Uiso   1.00
C3675  C     0.59772   0.74999  -0.45259   0.00000  Uiso   1.00
C3676  C     0.58902   0.74805  -0.45021   0.00000  Uiso   1.00
H3677  H     0.60540   0.72828  -0.45478   0.00000  Uiso   1.00
H3678  H     0.59978   0.75700  -0.45313   0.00000  Uiso   1.00
H3679  H     0.58980   0.72523  -0.45051   0.00000  Uiso   1.00
H3680  H     0.58428   0.75348  -0.44889   0.00000  Uiso   1.00
C3681  C     0.62355   0.75480  -0.45967   0.00000  Uiso   1.00
N3682  N     0.62959   0.74832  -0.46133   0.00000  Uiso   1.00
C3683  C     0.62643   0.73992  -0.46053   0.00000  Uiso   1.00
N3684  N     0.61800   0.73773  -0.45824   0.00000  Uiso   1.00
C3685  C     0.61257   0.74476  -0.45671   0.00000  Uiso   1.00
N3686  N     0.61496   0.75342  -0.45733   0.00000  Uiso   1.00
C3687  C     0.64422   0.71888  -0.46631   0.00000  Uiso   1.00
C3688  C     0.64703   0.72802  -0.46665   0.00000  Uiso   1.00
C3689  C     0.64131   0.73485  -0.46474   0.00000  Uiso   1.00
C3690  C     0.63231   0.73301  -0.46225   0.00000  Uiso   1.00
C3691  C     0.62942   0.72396  -0.46171   0.00000  Uiso   1.00
C3692  C     0.63518   0.71718  -0.46369   0.00000  Uiso   1.00
H3693  H     0.64374   0.74175  -0.46522   0.00000  Uiso   1.00
H3694  H     0.62253   0.72231  -0.45979   0.00000  Uiso   1.00
H3695  H     0.65388   0.72967  -0.46871   0.00000  Uiso   1.00
H3696  H     0.63274   0.71027  -0.46324   0.00000  Uiso   1.00
H3697  H     0.61899   0.85432  -0.48799   0.00000  Uiso   1.00
H3698  H     0.68723   0.83699  -0.45849   0.00000  Uiso   1.00
H3699  H     0.57927   0.73771  -0.44758   0.00000  Uiso   1.00
C3700  C     0.78370   0.68298  -0.50030   0.00000  Uiso   1.00
C3701  C     0.78216   0.67538  -0.50589   0.00000  Uiso   1.00
C3702  C     0.78758   0.67346  -0.51297   0.00000  Uiso   1.00
C3703  C     0.79500   0.67908  -0.51496   0.00000  Uiso   1.00
C3704  C     0.79669   0.68665  -0.50945   0.00000  Uiso   1.00
C3705  C     0.79125   0.68848  -0.50237   0.00000  Uiso   1.00
H3706  H     0.78610   0.66757  -0.51707   0.00000  Uiso   1.00
H3707  H     0.80235   0.69111  -0.51082   0.00000  Uiso   1.00
C3708  C     0.77780   0.68511  -0.49303   0.00000  Uiso   1.00
C3709  C     0.78101   0.68915  -0.48498   0.00000  Uiso   1.00
C3710  C     0.77538   0.69128  -0.47813   0.00000  Uiso   1.00
C3711  C     0.76605   0.68957  -0.47889   0.00000  Uiso   1.00
C3712  C     0.76272   0.68555  -0.48685   0.00000  Uiso   1.00
C3713  C     0.76841   0.68339  -0.49363   0.00000  Uiso   1.00
H3714  H     0.77650   0.67092  -0.50452   0.00000  Uiso   1.00
H3715  H     0.79266   0.69444  -0.49833   0.00000  Uiso   1.00
H3716  H     0.78818   0.69054  -0.48419   0.00000  Uiso   1.00
H3717  H     0.77816   0.69438  -0.47209   0.00000  Uiso   1.00
H3718  H     0.75556   0.68416  -0.48766   0.00000  Uiso   1.00
H3719  H     0.76561   0.68041  -0.49972   0.00000  Uiso   1.00
C3720  C     0.83390   0.69756  -0.53658   0.00000  Uiso   1.00
C3721  C     0.82841   0.69940  -0.52927   0.00000  Uiso   1.00
C3722  C     0.82128   0.69388  -0.52729   0.00000  Uiso   1.00
C3723  C     0.81952   0.68627  -0.53274   0.00000  Uiso   1.00
C3724  C     0.82520   0.68449  -0.54017   0.00000  Uiso   1.00
C3725  C     0.83228   0.69013  -0.54200   0.00000  Uiso   1.00
C3726  C     0.81241   0.68072  -0.53083   0.00000  Uiso   1.00
N3727  N     0.81111   0.67364  -0.53625   0.00000  Uiso   1.00
C3728  C     0.80404   0.66850  -0.53405   0.00000  Uiso   1.00
N3729  N     0.79848   0.66996  -0.52711   0.00000  Uiso   1.00
C3730  C     0.80046   0.67722  -0.52217   0.00000  Uiso   1.00
N3731  N     0.80732   0.68284  -0.52371   0.00000  Uiso   1.00
H3732  H     0.81706   0.69546  -0.52151   0.00000  Uiso   1.00
H3733  H     0.82406   0.67870  -0.54453   0.00000  Uiso   1.00
H3734  H     0.82977   0.70526  -0.52507   0.00000  Uiso   1.00
H3735  H     0.83666   0.68879  -0.54772   0.00000  Uiso   1.00
C3736  C     0.79895   0.64619  -0.55001   0.00000  Uiso   1.00
C3737  C     0.80620   0.65172  -0.55199   0.00000  Uiso   1.00
C3738  C     0.80796   0.65914  -0.54678   0.00000  Uiso   1.00
C3739  C     0.80236   0.66114  -0.53934   0.00000  Uiso   1.00
C3740  C     0.79499   0.65542  -0.53743   0.00000  Uiso   1.00
C3741  C     0.79338   0.64806  -0.54275   0.00000  Uiso   1.00
H3742  H     0.81370   0.66338  -0.54846   0.00000  Uiso   1.00
H3743  H     0.79053   0.65675  -0.53177   0.00000  Uiso   1.00
H3744  H     0.81050   0.65016  -0.55771   0.00000  Uiso   1.00
H3745  H     0.78771   0.64364  -0.54129   0.00000  Uiso   1.00
C3746  C     0.76752   0.70856  -0.43453   0.00000  Uiso   1.00
C3747  C     0.75834   0.70735  -0.43563   0.00000  Uiso   1.00
C3748  C     0.75500   0.70395  -0.44353   0.00000  Uiso   1.00
C3749  C     0.76097   0.70161  -0.45059   0.00000  Uiso   1.00
C3750  C     0.77032   0.70298  -0.44938   0.00000  Uiso   1.00
C3751  C     0.77346   0.70638  -0.44139   0.00000  Uiso   1.00
H3752  H     0.74777   0.70296  -0.44420   0.00000  Uiso   1.00
H3753  H     0.77511   0.70124  -0.45464   0.00000  Uiso   1.00
H3754  H     0.75376   0.70910  -0.43017   0.00000  Uiso   1.00
H3755  H     0.78066   0.70738  -0.44043   0.00000  Uiso   1.00
C3756  C     0.76026   0.69186  -0.47207   0.00000  Uiso   1.00
N3757  N     0.75152   0.69013  -0.47336   0.00000  Uiso   1.00
C3758  C     0.74614   0.69262  -0.46658   0.00000  Uiso   1.00
N3759  N     0.74887   0.69651  -0.45893   0.00000  Uiso   1.00
C3760  C     0.75777   0.69782  -0.45835   0.00000  Uiso   1.00
N3761  N     0.76378   0.69566  -0.46471   0.00000  Uiso   1.00
C3762  C     0.71854   0.68827  -0.46981   0.00000  Uiso   1.00
C3763  C     0.72483   0.68542  -0.47643   0.00000  Uiso   1.00
C3764  C     0.73378   0.68684  -0.47542   0.00000  Uiso   1.00
C3765  C     0.73709   0.69108  -0.46757   0.00000  Uiso   1.00
C3766  C     0.73096   0.69378  -0.46080   0.00000  Uiso   1.00
C3767  C     0.72202   0.69246  -0.46194   0.00000  Uiso   1.00
H3768  H     0.73833   0.68467  -0.48074   0.00000  Uiso   1.00
H3769  H     0.73332   0.69706  -0.45468   0.00000  Uiso   1.00
H3770  H     0.72244   0.68226  -0.48261   0.00000  Uiso   1.00
H3771  H     0.71742   0.69470  -0.45667   0.00000  Uiso   1.00
H3772  H     0.83954   0.70200  -0.53809   0.00000  Uiso   1.00
H3773  H     0.79761   0.64032  -0.55419   0.00000  Uiso   1.00
H3774  H     0.77010   0.71126  -0.42822   0.00000  Uiso   1.00
C3775  C     0.71062   0.61757  -0.52882   0.00000  Uiso   1.00
C3776  C     0.70627   0.60906  -0.52896   0.00000  Uiso   1.00
C3777  C     0.71065   0.60148  -0.53155   0.00000  Uiso   1.00
C3778  C     0.71976   0.60192  -0.53427   0.00000  Uiso   1.00
C3779  C     0.72420   0.61034  -0.53424   0.00000  Uiso   1.00
C3780  C     0.71977   0.61786  -0.53158   0.00000  Uiso   1.00
H3781  H     0.70704   0.59510  -0.53149   0.00000  Uiso   1.00
H3782  H     0.73121   0.61091  -0.53631   0.00000  Uiso   1.00
C3783  C     0.70599   0.62551  -0.52601   0.00000  Uiso   1.00
C3784  C     0.71050   0.63252  -0.52133   0.00000  Uiso   1.00
C3785  C     0.70614   0.64006  -0.51863   0.00000  Uiso   1.00
C3786  C     0.69687   0.64116  -0.52051   0.00000  Uiso   1.00
C3787  C     0.69226   0.63426  -0.52517   0.00000  Uiso   1.00
C3788  C     0.69668   0.62673  -0.52778   0.00000  Uiso   1.00
H3789  H     0.69928   0.60848  -0.52682   0.00000  Uiso   1.00
H3790  H     0.72337   0.62425  -0.53169   0.00000  Uiso   1.00
H3791  H     0.71764   0.63186  -0.51974   0.00000  Uiso   1.00
H3792  H     0.70989   0.64524  -0.51504   0.00000  Uiso   1.00
H3793  H     0.68512   0.63490  -0.52672   0.00000  Uiso   1.00
H3794  H     0.69294   0.62157  -0.53143   0.00000  Uiso   1.00
C3795  C     0.76356   0.58926  -0.54997   0.00000  Uiso   1.00
C3796  C     0.75904   0.59697  -0.54726   0.00000  Uiso   1.00
C3797  C     0.75023   0.59650  -0.54457   0.00000  Uiso   1.00
C3798  C     0.74572   0.58811  -0.54453   0.00000  Uiso   1.00
C3799  C     0.75044   0.58031  -0.54730   0.00000  Uiso   1.00
C3800  C     0.75925   0.58098  -0.54997   0.00000  Uiso   1.00
C3801  C     0.73691   0.58756  -0.54188   0.00000  Uiso   1.00
N3802  N     0.73305   0.57942  -0.54199   0.00000  Uiso   1.00
C3803  C     0.72444   0.57932  -0.53935   0.00000  Uiso   1.00
N3804  N     0.71969   0.58652  -0.53675   0.00000  Uiso   1.00
C3805  C     0.72426   0.59429  -0.53690   0.00000  Uiso   1.00
N3806  N     0.73286   0.59522  -0.53939   0.00000  Uiso   1.00
H3807  H     0.74682   0.60264  -0.54248   0.00000  Uiso   1.00
H3808  H     0.74720   0.57374  -0.54737   0.00000  Uiso   1.00
H3809  H     0.76253   0.60342  -0.54729   0.00000  Uiso   1.00
H3810  H     0.76290   0.57499  -0.55212   0.00000  Uiso   1.00
C3811  C     0.71140   0.55465  -0.53915   0.00000  Uiso   1.00
C3812  C     0.72034   0.55513  -0.54179   0.00000  Uiso   1.00
C3813  C     0.72473   0.56324  -0.54192   0.00000  Uiso   1.00
C3814  C     0.72013   0.57117  -0.53931   0.00000  Uiso   1.00
C3815  C     0.71101   0.57055  -0.53663   0.00000  Uiso   1.00
C3816  C     0.70678   0.56235  -0.53658   0.00000  Uiso   1.00
H3817  H     0.73175   0.56345  -0.54402   0.00000  Uiso   1.00
H3818  H     0.70726   0.57650  -0.53457   0.00000  Uiso   1.00
H3819  H     0.72386   0.54902  -0.54377   0.00000  Uiso   1.00
H3820  H     0.69976   0.56186  -0.53452   0.00000  Uiso   1.00
C3821  C     0.70602   0.68307  -0.49825   0.00000  Uiso   1.00
C3822  C     0.69688   0.68389  -0.49991   0.00000  Uiso   1.00
C3823  C     0.69224   0.67700  -0.50395   0.00000  Uiso   1.00
C3824  C     0.69684   0.66907  -0.50654   0.00000  Uiso   1.00
C3825  C     0.70614   0.66830  -0.50467   0.00000  Uiso   1.00
C3826  C     0.71060   0.67528  -0.50060   0.00000  Uiso   1.00
H3827  H     0.68508   0.67784  -0.50526   0.00000  Uiso   1.00
H3828  H     0.70990   0.66229  -0.50654   0.00000  Uiso   1.00
H3829  H     0.69337   0.69003  -0.49797   0.00000  Uiso   1.00
H3830  H     0.71778   0.67474  -0.49921   0.00000  Uiso   1.00
C3831  C     0.69241   0.64881  -0.51787   0.00000  Uiso   1.00
N3832  N     0.68367   0.64940  -0.51995   0.00000  Uiso   1.00
C3833  C     0.67964   0.65696  -0.51721   0.00000  Uiso   1.00
N3834  N     0.68363   0.66365  -0.51271   0.00000  Uiso   1.00
C3835  C     0.69239   0.66235  -0.51102   0.00000  Uiso   1.00
N3836  N     0.69714   0.65508  -0.51343   0.00000  Uiso   1.00
C3837  C     0.65198   0.65910  -0.52164   0.00000  Uiso   1.00
C3838  C     0.65695   0.65158  -0.52485   0.00000  Uiso   1.00
C3839  C     0.66598   0.65102  -0.52371   0.00000  Uiso   1.00
C3840  C     0.67064   0.65790  -0.51909   0.00000  Uiso   1.00
C3841  C     0.66587   0.66556  -0.51606   0.00000  Uiso   1.00
C3842  C     0.65686   0.66613  -0.51733   0.00000  Uiso   1.00
H3843  H     0.66949   0.64506  -0.52614   0.00000  Uiso   1.00
H3844  H     0.66930   0.67096  -0.51248   0.00000  Uiso   1.00
H3845  H     0.65344   0.64608  -0.52824   0.00000  Uiso   1.00
H3846  H     0.65328   0.67198  -0.51472   0.00000  Uiso   1.00
H3847  H     0.77056   0.58972  -0.55210   0.00000  Uiso   1.00
H3848  H     0.70797   0.54817  -0.53907   0.00000  Uiso   1.00
H3849  H     0.70964   0.68858  -0.49504   0.00000  Uiso   1.00
C3850  C     0.53676   0.71725  -0.59381   0.00000  Uiso   1.00
C3851  C     0.53529   0.70875  -0.59795   0.00000  Uiso   1.00
C3852  C     0.52802   0.70721  -0.60323   0.00000  Uiso   1.00
C3853  C     0.52160   0.71409  -0.60467   0.00000  Uiso   1.00
C3854  C     0.52294   0.72260  -0.60061   0.00000  Uiso   1.00
C3855  C     0.53027   0.72410  -0.59542   0.00000  Uiso   1.00
H3856  H     0.52718   0.70059  -0.60627   0.00000  Uiso   1.00
H3857  H     0.51811   0.72803  -0.60159   0.00000  Uiso   1.00
C3858  C     0.54436   0.71882  -0.58819   0.00000  Uiso   1.00
C3859  C     0.54878   0.72730  -0.58805   0.00000  Uiso   1.00
C3860  C     0.55594   0.72887  -0.58263   0.00000  Uiso   1.00
C3861  C     0.55918   0.72202  -0.57687   0.00000  Uiso   1.00
C3862  C     0.55490   0.71352  -0.57692   0.00000  Uiso   1.00
C3863  C     0.54778   0.71200  -0.58242   0.00000  Uiso   1.00
H3864  H     0.54013   0.70333  -0.59697   0.00000  Uiso   1.00
H3865  H     0.53107   0.73069  -0.59230   0.00000  Uiso   1.00
H3866  H     0.54644   0.73271  -0.59243   0.00000  Uiso   1.00
H3867  H     0.55911   0.73548  -0.58277   0.00000  Uiso   1.00
H3868  H     0.55723   0.70810  -0.57256   0.00000  Uiso   1.00
H3869  H     0.54455   0.70541  -0.58223   0.00000  Uiso   1.00
C3870  C     0.48211   0.73754  -0.61929   0.00000  Uiso   1.00
C3871  C     0.48972   0.73916  -0.61414   0.00000  Uiso   1.00
C3872  C     0.49606   0.73256  -0.61299   0.00000  Uiso   1.00
C3873  C     0.49482   0.72404  -0.61706   0.00000  Uiso   1.00
C3874  C     0.48702   0.72250  -0.62230   0.00000  Uiso   1.00
C3875  C     0.48079   0.72923  -0.62335   0.00000  Uiso   1.00
C3876  C     0.50108   0.71737  -0.61590   0.00000  Uiso   1.00
N3877  N     0.49951   0.70946  -0.61991   0.00000  Uiso   1.00
C3878  C     0.50583   0.70321  -0.61850   0.00000  Uiso   1.00
N3879  N     0.51326   0.70434  -0.61353   0.00000  Uiso   1.00
C3880  C     0.51412   0.71252  -0.60986   0.00000  Uiso   1.00
N3881  N     0.50827   0.71929  -0.61082   0.00000  Uiso   1.00
H3882  H     0.50197   0.73398  -0.60890   0.00000  Uiso   1.00
H3883  H     0.48584   0.71603  -0.62553   0.00000  Uiso   1.00
H3884  H     0.49065   0.74572  -0.61100   0.00000  Uiso   1.00
H3885  H     0.47478   0.72807  -0.62737   0.00000  Uiso   1.00
C3886  C     0.50220   0.67829  -0.63052   0.00000  Uiso   1.00
C3887  C     0.49583   0.68500  -0.63177   0.00000  Uiso   1.00
C3888  C     0.49693   0.69327  -0.62782   0.00000  Uiso   1.00
C3889  C     0.50461   0.69497  -0.62245   0.00000  Uiso   1.00
C3890  C     0.51103   0.68804  -0.62123   0.00000  Uiso   1.00
C3891  C     0.50976   0.67984  -0.62526   0.00000  Uiso   1.00
H3892  H     0.49184   0.69843  -0.62891   0.00000  Uiso   1.00
H3893  H     0.51702   0.68910  -0.61714   0.00000  Uiso   1.00
H3894  H     0.48993   0.68367  -0.63592   0.00000  Uiso   1.00
H3895  H     0.51470   0.67450  -0.62434   0.00000  Uiso   1.00
C3896  C     0.58990   0.75774  -0.56665   0.00000  Uiso   1.00
C3897  C     0.59292   0.75112  -0.56081   0.00000  Uiso   1.00
C3898  C     0.58872   0.74291  -0.56049   0.00000  Uiso   1.00
C3899  C     0.58126   0.74118  -0.56617   0.00000  Uiso   1.00
C3900  C     0.57824   0.74804  -0.57205   0.00000  Uiso   1.00
C3901  C     0.58258   0.75618  -0.57223   0.00000  Uiso   1.00
H3902  H     0.59124   0.73780  -0.55588   0.00000  Uiso   1.00
H3903  H     0.57253   0.74695  -0.57651   0.00000  Uiso   1.00
H3904  H     0.59868   0.75246  -0.55647   0.00000  Uiso   1.00
H3905  H     0.58028   0.76146  -0.57677   0.00000  Uiso   1.00
C3906  C     0.56636   0.72361  -0.57129   0.00000  Uiso   1.00
N3907  N     0.56903   0.71688  -0.56593   0.00000  Uiso   1.00
C3908  C     0.57602   0.71884  -0.56061   0.00000  Uiso   1.00
N3909  N     0.58032   0.72676  -0.56037   0.00000  Uiso   1.00
C3910  C     0.57708   0.73296  -0.56604   0.00000  Uiso   1.00
N3911  N     0.57012   0.73179  -0.57163   0.00000  Uiso   1.00
C3912  C     0.58587   0.69830  -0.54409   0.00000  Uiso   1.00
C3913  C     0.57827   0.69694  -0.54973   0.00000  Uiso   1.00
C3914  C     0.57499   0.70360  -0.55503   0.00000  Uiso   1.00
C3915  C     0.57908   0.71219  -0.55499   0.00000  Uiso   1.00
C3916  C     0.58649   0.71376  -0.54923   0.00000  Uiso   1.00
C3917  C     0.58970   0.70704  -0.54396   0.00000  Uiso   1.00
H3918  H     0.56927   0.70218  -0.55939   0.00000  Uiso   1.00
H3919  H     0.58977   0.72031  -0.54900   0.00000  Uiso   1.00
H3920  H     0.57514   0.69031  -0.55016   0.00000  Uiso   1.00
H3921  H     0.59549   0.70845  -0.53967   0.00000  Uiso   1.00
H3922  H     0.47712   0.74284  -0.62017   0.00000  Uiso   1.00
H3923  H     0.50126   0.67175  -0.63369   0.00000  Uiso   1.00
H3924  H     0.59329   0.76424  -0.56685   0.00000  Uiso   1.00
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_ccdc_geom_bond_type
C1     C6      1.435   .     S
C1     C2      1.433   .     S
C1     C9      1.439   .     S
C2     C3      1.368   .     S
C2     H15     1.101   .     S
C3     H7      1.100   .     S
C3     C4      1.428   .     S
C4     C5      1.428   .     S
C4     C31     1.384   .     S
C5     H8      1.100   .     S
C5     C6      1.367   .     S
C6     H16     1.101   .     S
C9     C14     1.434   .     S
C9     C10     1.434   .     S
C10    C11     1.368   .     S
C10    H17     1.101   .     S
C11    H18     1.100   .     S
C11    C12     1.427   .     S
C12    C57     1.385   .     S
C12    C13     1.427   .     S
C13    C14     1.369   .     S
C13    H19     1.101   .     S
C14    H20     1.101   .     S
C21    C22     1.433   .     S
C21    C26     1.428   .     S
C21    C191    1.449   .     S
C22    C23     1.367   .     S
C22    H35     1.100   .     S
C23    H33     1.099   .     S
C23    C24     1.425   .     S
C24    C27     1.385   .     S
C24    C25     1.427   .     S
C25    H34     1.099   .     S
C25    C26     1.369   .     S
C26    H36     1.101   .     S
C27    N28     1.347   .     S
C27    N32     1.350   .     S
N28    C29     1.351   .     S
C29    N30     1.351   .     S
C29    C40     1.383   .     S
N30    C31     1.351   .     S
C31    N32     1.351   .     S
C37    C42     1.432   .     S
C37    C38     1.434   .     S
C37    C263    1.442   .     S
C38    H45     1.100   .     S
C38    C39     1.366   .     S
C39    C40     1.426   .     S
C39    H43     1.100   .     S
C40    C41     1.427   .     S
C41    H44     1.099   .     S
C41    C42     1.368   .     S
C42    H46     1.101   .     S
C47    C48     1.437   .     S
C47    C135    1.431   .     S
C47    C52     1.436   .     S
C48    H55     1.101   .     S
C48    C49     1.369   .     S
C49    H53     1.100   .     S
C49    C50     1.428   .     S
C50    C51     1.428   .     S
C50    C61     1.384   .     S
C51    C52     1.365   .     S
C51    H54     1.101   .     S
C52    H56     1.101   .     S
C57    N62     1.349   .     S
C57    N58     1.349   .     S
N58    C59     1.351   .     S
C59    C66     1.385   .     S
C59    N60     1.351   .     S
N60    C61     1.351   .     S
C61    N62     1.351   .     S
C63    C309    1.451   .     S
C63    C68     1.431   .     S
C63    C64     1.431   .     S
C64    H71     1.100   .     S
C64    C65     1.367   .     S
C65    H69     1.101   .     S
C65    C66     1.426   .     S
C66    C67     1.428   .     S
C67    H70     1.100   .     S
C67    C68     1.369   .     S
C68    H72     1.101   .     S
C73    C78     1.435   .     S
C73    C74     1.433   .     S
C73    C81     1.437   .     S
C74    C75     1.366   .     S
C74    H87     1.100   .     S
C75    C76     1.427   .     S
C75    H79     1.100   .     S
C76    C77     1.426   .     S
C76    C103    1.384   .     S
C77    C78     1.367   .     S
C77    H80     1.100   .     S
C78    H88     1.101   .     S
C81    C86     1.435   .     S
C81    C82     1.433   .     S
C82    H89     1.101   .     S
C82    C83     1.366   .     S
C83    H90     1.100   .     S
C83    C84     1.427   .     S
C84    C129    1.384   .     S
C84    C85     1.426   .     S
C85    H91     1.099   .     S
C85    C86     1.368   .     S
C86    H92     1.100   .     S
C93    C94     1.431   .     S
C93    C98     1.435   .     S
C93    C397    1.442   .     S
C94    H107    1.101   .     S
C94    C95     1.367   .     S
C95    C96     1.429   .     S
C95    H105    1.100   .     S
C96    C97     1.426   .     S
C96    C99     1.383   .     S
C97    C98     1.368   .     S
C97    H106    1.100   .     S
C98    H108    1.100   .     S
C99    N104    1.352   .     S
C99    N100    1.354   .     S
N100   C101    1.349   .     S
C101   N102    1.349   .     S
C101   C112    1.385   .     S
N102   C103    1.347   .     S
C103   N104    1.347   .     S
C109   C479    1.448   .     S
C109   C114    1.429   .     S
C109   C110    1.432   .     S
C110   C111    1.371   .     S
C110   H117    1.101   .     S
C111   C112    1.427   .     S
C111   H115    1.099   .     S
C112   C113    1.426   .     S
C113   C114    1.364   .     S
C113   H116    1.100   .     S
C114   H118    1.101   .     S
C119   C927    1.430   .     S
C119   C120    1.436   .     S
C119   C124    1.438   .     S
C120   H127    1.099   .     S
C120   C121    1.369   .     S
C121   H125    1.101   .     S
C121   C122    1.428   .     S
C122   C123    1.429   .     S
C122   C133    1.384   .     S
C123   H126    1.099   .     S
C123   C124    1.365   .     S
C124   H128    1.100   .     S
C129   N134    1.346   .     S
C129   N130    1.347   .     S
N130   C131    1.354   .     S
C131   C138    1.384   .     S
C131   N132    1.353   .     S
N132   C133    1.351   .     S
C133   N134    1.351   .     S
C135   C136    1.436   .     S
C135   C140    1.439   .     S
C136   C137    1.364   .     S
C136   H143    1.101   .     S
C137   C138    1.429   .     S
C137   H141    1.100   .     S
C138   C139    1.429   .     S
C139   C140    1.370   .     S
C139   H142    1.100   .     S
C140   H144    1.100   .     S
C145   C150    1.435   .     S
C145   C153    1.437   .     S
C145   C146    1.435   .     S
C146   H159    1.101   .     S
C146   C147    1.366   .     S
C147   C148    1.427   .     S
C147   H151    1.100   .     S
C148   C175    1.385   .     S
C148   C149    1.426   .     S
C149   C150    1.368   .     S
C149   H152    1.099   .     S
C150   H160    1.100   .     S
C153   C158    1.434   .     S
C153   C154    1.435   .     S
C154   C155    1.367   .     S
C154   H161    1.100   .     S
C155   H162    1.100   .     S
C155   C156    1.427   .     S
C156   C201    1.385   .     S
C156   C157    1.427   .     S
C157   C158    1.368   .     S
C157   H163    1.099   .     S
C158   H164    1.101   .     S
C165   C1173   1.448   .     S
C165   C170    1.434   .     S
C165   C166    1.429   .     S
C166   H179    1.100   .     S
C166   C167    1.364   .     S
C167   H177    1.099   .     S
C167   C168    1.428   .     S
C168   C169    1.428   .     S
C168   C171    1.385   .     S
C169   H178    1.100   .     S
C169   C170    1.373   .     S
C170   H180    1.100   .     S
C171   N172    1.353   .     S
C171   N176    1.354   .     S
N172   C173    1.353   .     S
C173   N174    1.352   .     S
C173   C184    1.385   .     S
N174   C175    1.345   .     S
C175   N176    1.345   .     S
C181   C186    1.429   .     S
C181   C182    1.438   .     S
C181   C566    1.441   .     S
C182   C183    1.373   .     S
C182   H189    1.101   .     S
C183   C184    1.427   .     S
C183   H187    1.100   .     S
C184   C185    1.429   .     S
C185   C186    1.364   .     S
C185   H188    1.100   .     S
C186   H190    1.101   .     S
C191   C192    1.434   .     S
C191   C196    1.429   .     S
C192   H199    1.101   .     S
C192   C193    1.369   .     S
C193   C194    1.427   .     S
C193   H197    1.100   .     S
C194   C205    1.384   .     S
C194   C195    1.426   .     S
C195   C196    1.365   .     S
C195   H198    1.100   .     S
C196   H200    1.100   .     S
C201   N202    1.349   .     S
C201   N206    1.348   .     S
N202   C203    1.350   .     S
C203   N204    1.351   .     S
C203   C210    1.384   .     S
N204   C205    1.349   .     S
C205   N206    1.352   .     S
C207   C597    1.450   .     S
C207   C208    1.431   .     S
C207   C212    1.431   .     S
C208   H215    1.100   .     S
C208   C209    1.367   .     S
C209   C210    1.427   .     S
C209   H213    1.100   .     S
C210   C211    1.426   .     S
C211   C212    1.367   .     S
C211   H214    1.100   .     S
C212   H216    1.099   .     S
C217   C225    1.438   .     S
C217   C222    1.435   .     S
C217   C218    1.434   .     S
C218   H231    1.101   .     S
C218   C219    1.368   .     S
C219   C220    1.427   .     S
C219   H223    1.100   .     S
C220   C221    1.428   .     S
C220   C247    1.386   .     S
C221   C222    1.368   .     S
C221   H224    1.101   .     S
C222   H232    1.101   .     S
C225   C226    1.435   .     S
C225   C230    1.436   .     S
C226   H233    1.101   .     S
C226   C227    1.367   .     S
C227   H234    1.100   .     S
C227   C228    1.429   .     S
C228   C273    1.385   .     S
C228   C229    1.428   .     S
C229   C230    1.368   .     S
C229   H235    1.101   .     S
C230   H236    1.101   .     S
C237   C242    1.434   .     S
C237   C238    1.431   .     S
C237   C695    1.446   .     S
C238   H251    1.100   .     S
C238   C239    1.365   .     S
C239   C240    1.428   .     S
C239   H249    1.099   .     S
C240   C241    1.427   .     S
C240   C243    1.385   .     S
C241   H250    1.100   .     S
C241   C242    1.369   .     S
C242   H252    1.100   .     S
C243   N248    1.352   .     S
C243   N244    1.351   .     S
N244   C245    1.352   .     S
C245   N246    1.352   .     S
C245   C256    1.385   .     S
N246   C247    1.350   .     S
C247   N248    1.348   .     S
C253   C258    1.434   .     S
C253   C741    1.435   .     S
C253   C254    1.438   .     S
C254   H261    1.102   .     S
C254   C255    1.370   .     S
C255   C256    1.429   .     S
C255   H259    1.100   .     S
C256   C257    1.427   .     S
C257   H260    1.100   .     S
C257   C258    1.366   .     S
C258   H262    1.101   .     S
C263   C264    1.433   .     S
C263   C268    1.433   .     S
C264   C265    1.367   .     S
C264   H271    1.101   .     S
C265   C266    1.427   .     S
C265   H269    1.099   .     S
C266   C277    1.385   .     S
C266   C267    1.427   .     S
C267   C268    1.368   .     S
C267   H270    1.101   .     S
C268   H272    1.100   .     S
C273   N278    1.352   .     S
C273   N274    1.353   .     S
N274   C275    1.352   .     S
C275   N276    1.351   .     S
C275   C282    1.385   .     S
N276   C277    1.348   .     S
C277   N278    1.349   .     S
C279   C284    1.433   .     S
C279   C280    1.434   .     S
C279   C813    1.442   .     S
C280   H287    1.100   .     S
C280   C281    1.369   .     S
C281   H285    1.100   .     S
C281   C282    1.427   .     S
C282   C283    1.429   .     S
C283   H286    1.100   .     S
C283   C284    1.367   .     S
C284   H288    1.101   .     S
C289   C297    1.444   .     S
C289   C290    1.434   .     S
C289   C294    1.434   .     S
C290   H303    1.101   .     S
C290   C291    1.368   .     S
C291   H295    1.101   .     S
C291   C292    1.428   .     S
C292   C293    1.427   .     S
C292   C319    1.386   .     S
C293   C294    1.369   .     S
C293   H296    1.100   .     S
C294   H304    1.101   .     S
C297   C298    1.434   .     S
C297   C302    1.434   .     S
C298   C299    1.367   .     S
C298   H305    1.101   .     S
C299   H306    1.101   .     S
C299   C300    1.428   .     S
C300   C345    1.387   .     S
C300   C301    1.428   .     S
C301   C302    1.370   .     S
C301   H307    1.100   .     S
C302   H308    1.101   .     S
C309   C314    1.431   .     S
C309   C310    1.432   .     S
C310   H323    1.100   .     S
C310   C311    1.369   .     S
C311   C312    1.427   .     S
C311   H321    1.100   .     S
C312   C315    1.386   .     S
C312   C313    1.426   .     S
C313   H322    1.101   .     S
C313   C314    1.367   .     S
C314   H324    1.099   .     S
C315   N320    1.351   .     S
C315   N316    1.351   .     S
N316   C317    1.350   .     S
C317   C328    1.385   .     S
C317   N318    1.352   .     S
N318   C319    1.351   .     S
C319   N320    1.352   .     S
C325   C326    1.429   .     S
C325   C330    1.432   .     S
C325   C983    1.454   .     S
C326   C327    1.369   .     S
C326   H333    1.100   .     S
C327   C328    1.428   .     S
C327   H331    1.100   .     S
C328   C329    1.425   .     S
C329   C330    1.366   .     S
C329   H332    1.100   .     S
C330   H334    1.099   .     S
C335   C1071   1.444   .     S
C335   C340    1.430   .     S
C335   C336    1.434   .     S
C336   H343    1.100   .     S
C336   C337    1.370   .     S
C337   C338    1.428   .     S
C337   H341    1.101   .     S
C338   C349    1.385   .     S
C338   C339    1.426   .     S
C339   C340    1.367   .     S
C339   H342    1.100   .     S
C340   H344    1.100   .     S
C345   N346    1.351   .     S
C345   N350    1.349   .     S
N346   C347    1.354   .     S
C347   C354    1.385   .     S
C347   N348    1.353   .     S
N348   C349    1.350   .     S
C349   N350    1.351   .     S
C351   C1127   1.446   .     S
C351   C356    1.433   .     S
C351   C352    1.432   .     S
C352   C353    1.367   .     S
C352   H359    1.101   .     S
C353   H357    1.099   .     S
C353   C354    1.428   .     S
C354   C355    1.428   .     S
C355   H358    1.100   .     S
C355   C356    1.368   .     S
C356   H360    1.101   .     S
C361   C362    1.433   .     S
C361   C369    1.441   .     S
C361   C366    1.433   .     S
C362   H375    1.101   .     S
C362   C363    1.367   .     S
C363   H367    1.100   .     S
C363   C364    1.428   .     S
C364   C365    1.428   .     S
C364   C391    1.383   .     S
C365   H368    1.099   .     S
C365   C366    1.366   .     S
C366   H376    1.100   .     S
C369   C370    1.433   .     S
C369   C374    1.434   .     S
C370   H377    1.101   .     S
C370   C371    1.367   .     S
C371   H378    1.100   .     S
C371   C372    1.427   .     S
C372   C373    1.428   .     S
C372   C417    1.384   .     S
C373   H379    1.100   .     S
C373   C374    1.368   .     S
C374   H380    1.100   .     S
C381   C382    1.435   .     S
C381   C386    1.437   .     S
C381   C3237   1.435   .     S
C382   H395    1.101   .     S
C382   C383    1.368   .     S
C383   H393    1.101   .     S
C383   C384    1.428   .     S
C384   C385    1.426   .     S
C384   C387    1.385   .     S
C385   H394    1.100   .     S
C385   C386    1.367   .     S
C386   H396    1.100   .     S
C387   N392    1.349   .     S
C387   N388    1.349   .     S
N388   C389    1.351   .     S
C389   N390    1.350   .     S
C389   C400    1.385   .     S
N390   C391    1.351   .     S
C391   N392    1.351   .     S
C397   C398    1.430   .     S
C397   C402    1.435   .     S
C398   C399    1.368   .     S
C398   H405    1.100   .     S
C399   H403    1.100   .     S
C399   C400    1.427   .     S
C400   C401    1.426   .     S
C401   H404    1.100   .     S
C401   C402    1.369   .     S
C402   H406    1.101   .     S
C407   C3762   1.436   .     S
C407   C408    1.436   .     S
C407   C412    1.434   .     S
C408   C409    1.367   .     S
C408   H415    1.101   .     S
C409   C410    1.428   .     S
C409   H413    1.099   .     S
C410   C421    1.384   .     S
C410   C411    1.428   .     S
C411   C412    1.368   .     S
C411   H414    1.099   .     S
C412   H416    1.101   .     S
C417   N422    1.351   .     S
C417   N418    1.350   .     S
N418   C419    1.351   .     S
C419   N420    1.351   .     S
C419   C426    1.385   .     S
N420   C421    1.351   .     S
C421   N422    1.350   .     S
C423   C424    1.434   .     S
C423   C3687   1.440   .     S
C423   C428    1.434   .     S
C424   H431    1.101   .     S
C424   C425    1.369   .     S
C425   C426    1.427   .     S
C425   H429    1.099   .     S
C426   C427    1.428   .     S
C427   C428    1.367   .     S
C427   H430    1.100   .     S
C428   H432    1.100   .     S
C433   C441    1.436   .     S
C433   C434    1.436   .     S
C433   C438    1.435   .     S
C434   C435    1.366   .     S
C434   H447    1.101   .     S
C435   C436    1.427   .     S
C435   H439    1.100   .     S
C436   C463    1.384   .     S
C436   C437    1.429   .     S
C437   H440    1.101   .     S
C437   C438    1.367   .     S
C438   H448    1.102   .     S
C441   C442    1.436   .     S
C441   C446    1.434   .     S
C442   C443    1.367   .     S
C442   H449    1.102   .     S
C443   C444    1.430   .     S
C443   H450    1.100   .     S
C444   C489    1.383   .     S
C444   C445    1.428   .     S
C445   H451    1.099   .     S
C445   C446    1.367   .     S
C446   H452    1.101   .     S
C453   C3012   1.432   .     S
C453   C454    1.436   .     S
C453   C458    1.438   .     S
C454   C455    1.368   .     S
C454   H467    1.101   .     S
C455   H465    1.100   .     S
C455   C456    1.429   .     S
C456   C459    1.384   .     S
C456   C457    1.428   .     S
C457   C458    1.366   .     S
C457   H466    1.100   .     S
C458   H468    1.101   .     S
C459   N464    1.351   .     S
C459   N460    1.351   .     S
N460   C461    1.350   .     S
C461   C472    1.385   .     S
C461   N462    1.350   .     S
N462   C463    1.352   .     S
C463   N464    1.350   .     S
C469   C470    1.433   .     S
C469   C474    1.433   .     S
C469   C3087   1.444   .     S
C470   H477    1.100   .     S
C470   C471    1.367   .     S
C471   H475    1.100   .     S
C471   C472    1.427   .     S
C472   C473    1.428   .     S
C473   H476    1.099   .     S
C473   C474    1.368   .     S
C474   H478    1.101   .     S
C479   C480    1.431   .     S
C479   C484    1.433   .     S
C480   C481    1.364   .     S
C480   H487    1.100   .     S
C481   H485    1.100   .     S
C481   C482    1.426   .     S
C482   C483    1.427   .     S
C482   C493    1.385   .     S
C483   C484    1.370   .     S
C483   H486    1.100   .     S
C484   H488    1.100   .     S
C489   N494    1.353   .     S
C489   N490    1.354   .     S
N490   C491    1.348   .     S
C491   C498    1.386   .     S
C491   N492    1.349   .     S
N492   C493    1.349   .     S
C493   N494    1.349   .     S
C495   C500    1.432   .     S
C495   C496    1.435   .     S
C495   C3162   1.443   .     S
C496   H503    1.101   .     S
C496   C497    1.372   .     S
C497   H501    1.100   .     S
C497   C498    1.427   .     S
C498   C499    1.426   .     S
C499   H502    1.100   .     S
C499   C500    1.365   .     S
C500   H504    1.101   .     S
C505   C513    1.443   .     S
C505   C506    1.432   .     S
C505   C510    1.434   .     S
C506   C507    1.367   .     S
C506   H519    1.100   .     S
C507   H511    1.100   .     S
C507   C508    1.427   .     S
C508   C509    1.427   .     S
C508   C535    1.384   .     S
C509   C510    1.367   .     S
C509   H512    1.099   .     S
C510   H520    1.100   .     S
C513   C518    1.433   .     S
C513   C514    1.432   .     S
C514   C515    1.368   .     S
C514   H521    1.100   .     S
C515   H522    1.099   .     S
C515   C516    1.426   .     S
C516   C517    1.426   .     S
C516   C560    1.385   .     S
C517   C518    1.367   .     S
C517   H523    1.099   .     S
C518   H524    1.101   .     S
C525   C2862   1.441   .     S
C525   C526    1.432   .     S
C525   C530    1.435   .     S
C526   H539    1.100   .     S
C526   C527    1.366   .     S
C527   H537    1.100   .     S
C527   C528    1.428   .     S
C528   C531    1.384   .     S
C528   C529    1.428   .     S
C529   C530    1.369   .     S
C529   H538    1.100   .     S
C530   H540    1.101   .     S
C531   N532    1.352   .     S
C531   N536    1.350   .     S
N532   C533    1.351   .     S
C533   C544    1.384   .     S
C533   N534    1.352   .     S
N534   C535    1.348   .     S
C535   N536    1.349   .     S
C541   C542    1.432   .     S
C541   C546    1.431   .     S
C541   C2787   1.450   .     S
C542   C543    1.369   .     S
C542   H549    1.100   .     S
C543   C544    1.427   .     S
C543   H547    1.100   .     S
C544   C545    1.428   .     S
C545   C546    1.365   .     S
C545   H548    1.100   .     S
C546   H550    1.100   .     S
C551   C2937   1.438   .     S
C551   C556    1.434   .     S
C551   C552    1.435   .     S
C552   H559    1.100   .     S
C552   C553    1.370   .     S
C553   H557    1.100   .     S
C553   C554    1.427   .     S
C554   C555    1.427   .     S
C554   C564    1.384   .     S
C555   C556    1.365   .     S
C555   H558    1.099   .     S
C556   H576    1.101   .     S
C560   N565    1.347   .     S
C560   N561    1.347   .     S
N561   C562    1.352   .     S
C562   N563    1.351   .     S
C562   C569    1.385   .     S
N563   C564    1.352   .     S
C564   N565    1.352   .     S
C566   C571    1.434   .     S
C566   C567    1.434   .     S
C567   H574    1.102   .     S
C567   C568    1.364   .     S
C568   H572    1.100   .     S
C568   C569    1.427   .     S
C569   C570    1.429   .     S
C570   C571    1.372   .     S
C570   H573    1.100   .     S
C571   H575    1.101   .     S
C577   C578    1.438   .     S
C577   C585    1.430   .     S
C577   C582    1.435   .     S
C578   H591    1.101   .     S
C578   C579    1.368   .     S
C579   H583    1.099   .     S
C579   C580    1.426   .     S
C580   C581    1.428   .     S
C580   C607    1.382   .     S
C581   C582    1.366   .     S
C581   H584    1.100   .     S
C582   H592    1.101   .     S
C585   C590    1.435   .     S
C585   C586    1.438   .     S
C586   C587    1.366   .     S
C586   H593    1.101   .     S
C587   C588    1.428   .     S
C587   H594    1.100   .     S
C588   C589    1.427   .     S
C588   C633    1.384   .     S
C589   C590    1.367   .     S
C589   H595    1.099   .     S
C590   H596    1.101   .     S
C597   C598    1.431   .     S
C597   C602    1.432   .     S
C598   H611    1.100   .     S
C598   C599    1.366   .     S
C599   H609    1.100   .     S
C599   C600    1.426   .     S
C600   C601    1.426   .     S
C600   C603    1.383   .     S
C601   C602    1.368   .     S
C601   H610    1.100   .     S
C602   H612    1.100   .     S
C603   N604    1.349   .     S
C603   N608    1.349   .     S
N604   C605    1.352   .     S
C605   N606    1.350   .     S
C605   C616    1.383   .     S
N606   C607    1.349   .     S
C607   N608    1.348   .     S
C613   C618    1.431   .     S
C613   C2712   1.449   .     S
C613   C614    1.431   .     S
C614   C615    1.367   .     S
C614   H621    1.100   .     S
C615   H619    1.100   .     S
C615   C616    1.425   .     S
C616   C617    1.427   .     S
C617   C618    1.368   .     S
C617   H620    1.100   .     S
C618   H622    1.099   .     S
C623   C628    1.432   .     S
C623   C2412   1.446   .     S
C623   C624    1.432   .     S
C624   H631    1.100   .     S
C624   C625    1.369   .     S
C625   H629    1.100   .     S
C625   C626    1.427   .     S
C626   C637    1.384   .     S
C626   C627    1.427   .     S
C627   H630    1.101   .     S
C627   C628    1.367   .     S
C628   H632    1.100   .     S
C633   N634    1.348   .     S
C633   N638    1.348   .     S
N634   C635    1.350   .     S
C635   C642    1.384   .     S
C635   N636    1.350   .     S
N636   C637    1.352   .     S
C637   N638    1.350   .     S
C639   C2487   1.444   .     S
C639   C640    1.431   .     S
C639   C644    1.435   .     S
C640   H647    1.101   .     S
C640   C641    1.366   .     S
C641   H645    1.099   .     S
C641   C642    1.427   .     S
C642   C643    1.426   .     S
C643   H646    1.100   .     S
C643   C644    1.368   .     S
C644   H648    1.101   .     S
C649   C654    1.434   .     S
C649   C657    1.440   .     S
C649   C650    1.434   .     S
C650   C651    1.367   .     S
C650   H663    1.099   .     S
C651   C652    1.427   .     S
C651   H655    1.100   .     S
C652   C679    1.384   .     S
C652   C653    1.428   .     S
C653   C654    1.368   .     S
C653   H656    1.100   .     S
C654   H664    1.100   .     S
C657   C662    1.434   .     S
C657   C658    1.434   .     S
C658   C659    1.367   .     S
C658   H665    1.101   .     S
C659   C660    1.428   .     S
C659   H666    1.101   .     S
C660   C661    1.427   .     S
C660   C705    1.385   .     S
C661   H667    1.099   .     S
C661   C662    1.367   .     S
C662   H668    1.101   .     S
C669   C2562   1.441   .     S
C669   C674    1.434   .     S
C669   C670    1.434   .     S
C670   H683    1.101   .     S
C670   C671    1.367   .     S
C671   C672    1.427   .     S
C671   H681    1.099   .     S
C672   C673    1.428   .     S
C672   C675    1.385   .     S
C673   H682    1.100   .     S
C673   C674    1.368   .     S
C674   H684    1.101   .     S
C675   N676    1.350   .     S
C675   N680    1.350   .     S
N676   C677    1.352   .     S
C677   C688    1.385   .     S
C677   N678    1.350   .     S
N678   C679    1.351   .     S
C679   N680    1.352   .     S
C685   C2637   1.443   .     S
C685   C686    1.435   .     S
C685   C690    1.432   .     S
C686   C687    1.367   .     S
C686   H693    1.101   .     S
C687   H691    1.101   .     S
C687   C688    1.427   .     S
C688   C689    1.428   .     S
C689   C690    1.368   .     S
C689   H692    1.100   .     S
C690   H694    1.101   .     S
C695   C696    1.433   .     S
C695   C700    1.432   .     S
C696   H703    1.101   .     S
C696   C697    1.369   .     S
C697   H701    1.100   .     S
C697   C698    1.427   .     S
C698   C709    1.385   .     S
C698   C699    1.426   .     S
C699   H702    1.100   .     S
C699   C700    1.366   .     S
C700   H704    1.100   .     S
C705   N710    1.350   .     S
C705   N706    1.350   .     S
N706   C707    1.351   .     S
C707   N708    1.350   .     S
C707   C714    1.384   .     S
N708   C709    1.351   .     S
C709   N710    1.351   .     S
C711   C716    1.433   .     S
C711   C712    1.433   .     S
C711   C2337   1.442   .     S
C712   C713    1.366   .     S
C712   H719    1.101   .     S
C713   H717    1.100   .     S
C713   C714    1.428   .     S
C714   C715    1.428   .     S
C715   H718    1.100   .     S
C715   C716    1.369   .     S
C716   H720    1.100   .     S
C721   C729    1.442   .     S
C721   C722    1.433   .     S
C721   C726    1.434   .     S
C722   H735    1.101   .     S
C722   C723    1.367   .     S
C723   C724    1.427   .     S
C723   H727    1.100   .     S
C724   C725    1.427   .     S
C724   C751    1.384   .     S
C725   C726    1.367   .     S
C725   H728    1.100   .     S
C726   H736    1.101   .     S
C729   C730    1.433   .     S
C729   C734    1.433   .     S
C730   C731    1.368   .     S
C730   H737    1.101   .     S
C731   H738    1.100   .     S
C731   C732    1.428   .     S
C732   C733    1.428   .     S
C732   C777    1.384   .     S
C733   C734    1.367   .     S
C733   H739    1.100   .     S
C734   H740    1.101   .     S
C741   C746    1.436   .     S
C741   C742    1.437   .     S
C742   C743    1.365   .     S
C742   H755    1.100   .     S
C743   C744    1.428   .     S
C743   H753    1.101   .     S
C744   C745    1.429   .     S
C744   C747    1.385   .     S
C745   H754    1.100   .     S
C745   C746    1.370   .     S
C746   H756    1.102   .     S
C747   N748    1.350   .     S
C747   N752    1.352   .     S
N748   C749    1.352   .     S
C749   C760    1.384   .     S
C749   N750    1.350   .     S
N750   C751    1.349   .     S
C751   N752    1.350   .     S
C757   C758    1.433   .     S
C757   C2262   1.440   .     S
C757   C762    1.434   .     S
C758   C759    1.369   .     S
C758   H765    1.101   .     S
C759   C760    1.427   .     S
C759   H763    1.099   .     S
C760   C761    1.429   .     S
C761   H764    1.100   .     S
C761   C762    1.366   .     S
C762   H766    1.100   .     S
C767   C1887   1.443   .     S
C767   C768    1.433   .     S
C767   C772    1.434   .     S
C768   H775    1.101   .     S
C768   C769    1.368   .     S
C769   H773    1.099   .     S
C769   C770    1.427   .     S
C770   C771    1.427   .     S
C770   C781    1.385   .     S
C771   C772    1.367   .     S
C771   H774    1.100   .     S
C772   H776    1.101   .     S
C777   N778    1.351   .     S
C777   N782    1.351   .     S
N778   C779    1.351   .     S
C779   C786    1.385   .     S
C779   N780    1.351   .     S
N780   C781    1.351   .     S
C781   N782    1.350   .     S
C783   C2187   1.442   .     S
C783   C788    1.433   .     S
C783   C784    1.434   .     S
C784   C785    1.368   .     S
C784   H791    1.100   .     S
C785   C786    1.428   .     S
C785   H789    1.101   .     S
C786   C787    1.427   .     S
C787   C788    1.368   .     S
C787   H790    1.100   .     S
C788   H792    1.101   .     S
C793   C794    1.434   .     S
C793   C801    1.437   .     S
C793   C798    1.435   .     S
C794   H807    1.101   .     S
C794   C795    1.367   .     S
C795   H799    1.100   .     S
C795   C796    1.428   .     S
C796   C797    1.428   .     S
C796   C823    1.385   .     S
C797   C798    1.369   .     S
C797   H800    1.099   .     S
C798   H808    1.101   .     S
C801   C806    1.435   .     S
C801   C802    1.435   .     S
C802   H809    1.101   .     S
C802   C803    1.368   .     S
C803   H810    1.100   .     S
C803   C804    1.429   .     S
C804   C805    1.427   .     S
C804   C849    1.385   .     S
C805   H811    1.099   .     S
C805   C806    1.367   .     S
C806   H812    1.101   .     S
C813   C814    1.433   .     S
C813   C818    1.435   .     S
C814   H827    1.100   .     S
C814   C815    1.367   .     S
C815   C816    1.428   .     S
C815   H825    1.100   .     S
C816   C819    1.384   .     S
C816   C817    1.428   .     S
C817   C818    1.368   .     S
C817   H826    1.100   .     S
C818   H828    1.101   .     S
C819   N820    1.351   .     S
C819   N824    1.352   .     S
N820   C821    1.350   .     S
C821   N822    1.350   .     S
C821   C832    1.385   .     S
N822   C823    1.350   .     S
C823   N824    1.351   .     S
C829   C1962   1.440   .     S
C829   C834    1.433   .     S
C829   C830    1.434   .     S
C830   C831    1.368   .     S
C830   H837    1.101   .     S
C831   H835    1.100   .     S
C831   C832    1.427   .     S
C832   C833    1.427   .     S
C833   C834    1.366   .     S
C833   H836    1.100   .     S
C834   H838    1.100   .     S
C839   C844    1.431   .     S
C839   C840    1.431   .     S
C839   C2037   1.452   .     S
C840   C841    1.368   .     S
C840   H847    1.100   .     S
C841   H845    1.099   .     S
C841   C842    1.427   .     S
C842   C843    1.427   .     S
C842   C853    1.385   .     S
C843   H846    1.100   .     S
C843   C844    1.368   .     S
C844   H848    1.101   .     S
C849   N850    1.351   .     S
C849   N854    1.352   .     S
N850   C851    1.350   .     S
C851   N852    1.351   .     S
C851   C858    1.386   .     S
N852   C853    1.351   .     S
C853   N854    1.351   .     S
C855   C2112   1.446   .     S
C855   C860    1.433   .     S
C855   C856    1.432   .     S
C856   C857    1.368   .     S
C856   H863    1.100   .     S
C857   C858    1.427   .     S
C857   H861    1.100   .     S
C858   C859    1.427   .     S
C859   C860    1.369   .     S
C859   H862    1.100   .     S
C860   H864    1.101   .     S
C865   C866    1.435   .     S
C865   C873    1.436   .     S
C865   C870    1.435   .     S
C866   C867    1.367   .     S
C866   H879    1.101   .     S
C867   C868    1.428   .     S
C867   H871    1.100   .     S
C868   C895    1.385   .     S
C868   C869    1.429   .     S
C869   H872    1.100   .     S
C869   C870    1.367   .     S
C870   H880    1.101   .     S
C873   C874    1.437   .     S
C873   C878    1.435   .     S
C874   H881    1.101   .     S
C874   C875    1.368   .     S
C875   H882    1.100   .     S
C875   C876    1.428   .     S
C876   C921    1.384   .     S
C876   C877    1.429   .     S
C877   H883    1.099   .     S
C877   C878    1.366   .     S
C878   H884    1.101   .     S
C885   C886    1.435   .     S
C885   C3612   1.442   .     S
C885   C890    1.433   .     S
C886   C887    1.368   .     S
C886   H899    1.101   .     S
C887   H897    1.100   .     S
C887   C888    1.427   .     S
C888   C889    1.428   .     S
C888   C891    1.386   .     S
C889   C890    1.368   .     S
C889   H898    1.100   .     S
C890   H900    1.101   .     S
C891   N896    1.351   .     S
C891   N892    1.351   .     S
N892   C893    1.352   .     S
C893   N894    1.351   .     S
C893   C904    1.385   .     S
N894   C895    1.352   .     S
C895   N896    1.351   .     S
C901   C902    1.434   .     S
C901   C906    1.434   .     S
C901   C3462   1.441   .     S
C902   H909    1.101   .     S
C902   C903    1.367   .     S
C903   C904    1.428   .     S
C903   H907    1.100   .     S
C904   C905    1.429   .     S
C905   H908    1.100   .     S
C905   C906    1.368   .     S
C906   H910    1.101   .     S
C911   C1287   1.443   .     S
C911   C912    1.432   .     S
C911   C916    1.435   .     S
C912   H919    1.100   .     S
C912   C913    1.366   .     S
C913   H917    1.101   .     S
C913   C914    1.428   .     S
C914   C925    1.383   .     S
C914   C915    1.427   .     S
C915   H918    1.100   .     S
C915   C916    1.367   .     S
C916   H920    1.100   .     S
C921   N926    1.351   .     S
C921   N922    1.351   .     S
N922   C923    1.349   .     S
C923   C930    1.383   .     S
C923   N924    1.349   .     S
N924   C925    1.351   .     S
C925   N926    1.351   .     S
C927   C932    1.439   .     S
C927   C928    1.434   .     S
C928   H935    1.102   .     S
C928   C929    1.367   .     S
C929   H933    1.100   .     S
C929   C930    1.427   .     S
C930   C931    1.427   .     S
C931   H934    1.101   .     S
C931   C932    1.368   .     S
C932   H936    1.100   .     S
C937   C942    1.436   .     S
C937   C938    1.434   .     S
C937   C945    1.436   .     S
C938   H951    1.101   .     S
C938   C939    1.366   .     S
C939   H943    1.099   .     S
C939   C940    1.429   .     S
C940   C941    1.427   .     S
C940   C967    1.384   .     S
C941   H944    1.100   .     S
C941   C942    1.368   .     S
C942   H952    1.101   .     S
C945   C950    1.434   .     S
C945   C946    1.435   .     S
C946   H953    1.100   .     S
C946   C947    1.367   .     S
C947   H954    1.100   .     S
C947   C948    1.429   .     S
C948   C949    1.427   .     S
C948   C993    1.382   .     S
C949   C950    1.368   .     S
C949   H955    1.100   .     S
C950   H956    1.101   .     S
C957   C1812   1.422   .     S
C957   C962    1.441   .     S
C957   C958    1.445   .     S
C958   C959    1.370   .     S
C958   H971    1.100   .     S
C959   C960    1.429   .     S
C959   H969    1.100   .     S
C960   C963    1.386   .     S
C960   C961    1.429   .     S
C961   H970    1.100   .     S
C961   C962    1.367   .     S
C962   H972    1.101   .     S
C963   N964    1.355   .     S
C963   N968    1.354   .     S
N964   C965    1.349   .     S
C965   C976    1.386   .     S
C965   N966    1.349   .     S
N966   C967    1.348   .     S
C967   N968    1.351   .     S
C973   C1737   1.438   .     S
C973   C974    1.435   .     S
C973   C978    1.434   .     S
C974   C975    1.370   .     S
C974   H981    1.100   .     S
C975   C976    1.427   .     S
C975   H979    1.100   .     S
C976   C977    1.427   .     S
C977   C978    1.365   .     S
C977   H980    1.100   .     S
C978   H982    1.101   .     S
C983   C984    1.429   .     S
C983   C988    1.432   .     S
C984   C985    1.366   .     S
C984   H991    1.099   .     S
C985   C986    1.424   .     S
C985   H989    1.100   .     S
C986   C987    1.426   .     S
C986   C997    1.385   .     S
C987   H990    1.100   .     S
C987   C988    1.369   .     S
C988   H992    1.100   .     S
C993   N998    1.352   .     S
C993   N994    1.354   .     S
N994   C995    1.349   .     S
C995   C1002   1.384   .     S
C995   N996    1.350   .     S
N996   C997    1.348   .     S
C997   N998    1.347   .     S
C999   C1000   1.432   .     S
C999   C1004   1.434   .     S
C999   C1662   1.443   .     S
C1000  H1007   1.101   .     S
C1000  C1001   1.369   .     S
C1001  H1005   1.100   .     S
C1001  C1002   1.427   .     S
C1002  C1003   1.426   .     S
C1003  H1006   1.100   .     S
C1003  C1004   1.365   .     S
C1004  H1008   1.101   .     S
C1009  C1017   1.438   .     S
C1009  C1014   1.436   .     S
C1009  C1010   1.433   .     S
C1010  C1011   1.365   .     S
C1010  H1023   1.101   .     S
C1011  C1012   1.428   .     S
C1011  H1015   1.100   .     S
C1012  C1039   1.385   .     S
C1012  C1013   1.428   .     S
C1013  H1016   1.100   .     S
C1013  C1014   1.370   .     S
C1014  H1024   1.100   .     S
C1017  C1018   1.434   .     S
C1017  C1022   1.436   .     S
C1018  H1025   1.100   .     S
C1018  C1019   1.369   .     S
C1019  C1020   1.427   .     S
C1019  H1026   1.101   .     S
C1020  C1065   1.384   .     S
C1020  C1021   1.427   .     S
C1021  H1027   1.100   .     S
C1021  C1022   1.365   .     S
C1022  H1028   1.101   .     S
C1029  C1030   1.431   .     S
C1029  C3537   1.443   .     S
C1029  C1034   1.435   .     S
C1030  C1031   1.368   .     S
C1030  H1043   1.101   .     S
C1031  H1041   1.100   .     S
C1031  C1032   1.427   .     S
C1032  C1035   1.385   .     S
C1032  C1033   1.428   .     S
C1033  H1042   1.100   .     S
C1033  C1034   1.369   .     S
C1034  H1044   1.101   .     S
C1035  N1040   1.352   .     S
C1035  N1036   1.352   .     S
N1036  C1037   1.351   .     S
C1037  N1038   1.349   .     S
C1037  C1048   1.385   .     S
N1038  C1039   1.352   .     S
C1039  N1040   1.351   .     S
C1045  C1050   1.437   .     S
C1045  C1046   1.436   .     S
C1045  C3387   1.435   .     S
C1046  H1053   1.100   .     S
C1046  C1047   1.366   .     S
C1047  C1048   1.426   .     S
C1047  H1051   1.100   .     S
C1048  C1049   1.429   .     S
C1049  H1052   1.100   .     S
C1049  C1050   1.368   .     S
C1050  H1054   1.102   .     S
C1055  C1056   1.436   .     S
C1055  C1362   1.436   .     S
C1055  C1060   1.434   .     S
C1056  H1063   1.101   .     S
C1056  C1057   1.368   .     S
C1057  C1058   1.428   .     S
C1057  H1061   1.100   .     S
C1058  C1069   1.383   .     S
C1058  C1059   1.429   .     S
C1059  H1062   1.099   .     S
C1059  C1060   1.367   .     S
C1060  H1064   1.101   .     S
C1065  N1070   1.349   .     S
C1065  N1066   1.349   .     S
N1066  C1067   1.350   .     S
C1067  N1068   1.350   .     S
C1067  C1074   1.385   .     S
N1068  C1069   1.352   .     S
C1069  N1070   1.352   .     S
C1071  C1076   1.433   .     S
C1071  C1072   1.433   .     S
C1072  H1079   1.100   .     S
C1072  C1073   1.365   .     S
C1073  C1074   1.427   .     S
C1073  H1077   1.100   .     S
C1074  C1075   1.428   .     S
C1075  H1078   1.100   .     S
C1075  C1076   1.369   .     S
C1076  H1080   1.101   .     S
C1081  C1086   1.435   .     S
C1081  C1089   1.439   .     S
C1081  C1082   1.433   .     S
C1082  H1095   1.101   .     S
C1082  C1083   1.367   .     S
C1083  C1084   1.428   .     S
C1083  H1087   1.100   .     S
C1084  C1111   1.384   .     S
C1084  C1085   1.428   .     S
C1085  H1088   1.100   .     S
C1085  C1086   1.367   .     S
C1086  H1096   1.101   .     S
C1089  C1094   1.434   .     S
C1089  C1090   1.434   .     S
C1090  H1097   1.101   .     S
C1090  C1091   1.368   .     S
C1091  C1092   1.427   .     S
C1091  H1098   1.100   .     S
C1092  C1137   1.385   .     S
C1092  C1093   1.427   .     S
C1093  H1099   1.100   .     S
C1093  C1094   1.367   .     S
C1094  H1100   1.100   .     S
C1101  C1102   1.436   .     S
C1101  C1587   1.437   .     S
C1101  C1106   1.435   .     S
C1102  H1115   1.100   .     S
C1102  C1103   1.366   .     S
C1103  H1113   1.100   .     S
C1103  C1104   1.426   .     S
C1104  C1107   1.384   .     S
C1104  C1105   1.429   .     S
C1105  H1114   1.100   .     S
C1105  C1106   1.368   .     S
C1106  H1116   1.101   .     S
C1107  N1112   1.351   .     S
C1107  N1108   1.350   .     S
N1108  C1109   1.351   .     S
C1109  C1120   1.385   .     S
C1109  N1110   1.350   .     S
N1110  C1111   1.351   .     S
C1111  N1112   1.349   .     S
C1117  C1122   1.434   .     S
C1117  C1118   1.433   .     S
C1117  C1512   1.443   .     S
C1118  C1119   1.368   .     S
C1118  H1125   1.101   .     S
C1119  C1120   1.427   .     S
C1119  H1123   1.100   .     S
C1120  C1121   1.427   .     S
C1121  H1124   1.099   .     S
C1121  C1122   1.367   .     S
C1122  H1126   1.100   .     S
C1127  C1128   1.432   .     S
C1127  C1132   1.433   .     S
C1128  C1129   1.367   .     S
C1128  H1135   1.101   .     S
C1129  H1133   1.101   .     S
C1129  C1130   1.428   .     S
C1130  C1141   1.385   .     S
C1130  C1131   1.426   .     S
C1131  H1134   1.101   .     S
C1131  C1132   1.368   .     S
C1132  H1136   1.101   .     S
C1137  N1138   1.351   .     S
C1137  N1142   1.350   .     S
N1138  C1139   1.350   .     S
C1139  C1146   1.384   .     S
C1139  N1140   1.350   .     S
N1140  C1141   1.352   .     S
C1141  N1142   1.352   .     S
C1143  C1437   1.441   .     S
C1143  C1144   1.432   .     S
C1143  C1148   1.435   .     S
C1144  C1145   1.366   .     S
C1144  H1151   1.100   .     S
C1145  H1149   1.100   .     S
C1145  C1146   1.428   .     S
C1146  C1147   1.427   .     S
C1147  C1148   1.369   .     S
C1147  H1150   1.100   .     S
C1148  H1152   1.101   .     S
C1153  C1161   1.436   .     S
C1153  C1154   1.435   .     S
C1153  C1158   1.435   .     S
C1154  H1167   1.101   .     S
C1154  C1155   1.365   .     S
C1155  H1159   1.100   .     S
C1155  C1156   1.428   .     S
C1156  C1157   1.429   .     S
C1156  C1183   1.383   .     S
C1157  H1160   1.100   .     S
C1157  C1158   1.367   .     S
C1158  H1168   1.101   .     S
C1161  C1162   1.436   .     S
C1161  C1166   1.435   .     S
C1162  H1169   1.101   .     S
C1162  C1163   1.367   .     S
C1163  C1164   1.428   .     S
C1163  H1170   1.101   .     S
C1164  C1165   1.427   .     S
C1164  C1209   1.384   .     S
C1165  C1166   1.366   .     S
C1165  H1171   1.100   .     S
C1166  H1172   1.102   .     S
C1173  C1174   1.433   .     S
C1173  C1178   1.433   .     S
C1174  H1187   1.100   .     S
C1174  C1175   1.371   .     S
C1175  H1185   1.099   .     S
C1175  C1176   1.429   .     S
C1176  C1179   1.385   .     S
C1176  C1177   1.425   .     S
C1177  C1178   1.364   .     S
C1177  H1186   1.101   .     S
C1178  H1188   1.101   .     S
C1179  N1180   1.352   .     S
C1179  N1184   1.349   .     S
N1180  C1181   1.349   .     S
C1181  N1182   1.348   .     S
C1181  C1192   1.386   .     S
N1182  C1183   1.353   .     S
C1183  N1184   1.352   .     S
C1189  C3312   1.448   .     S
C1189  C1194   1.430   .     S
C1189  C1190   1.434   .     S
C1190  H1197   1.100   .     S
C1190  C1191   1.367   .     S
C1191  C1192   1.426   .     S
C1191  H1195   1.100   .     S
C1192  C1193   1.427   .     S
C1193  C1194   1.369   .     S
C1193  H1196   1.100   .     S
C1194  H1198   1.100   .     S
C1199  C1204   1.437   .     S
C1199  C3837   1.431   .     S
C1199  C1200   1.436   .     S
C1200  C1201   1.367   .     S
C1200  H1207   1.102   .     S
C1201  C1202   1.428   .     S
C1201  H1205   1.100   .     S
C1202  C1213   1.385   .     S
C1202  C1203   1.428   .     S
C1203  C1204   1.368   .     S
C1203  H1206   1.100   .     S
C1204  H1208   1.100   .     S
C1209  N1214   1.350   .     S
C1209  N1210   1.351   .     S
N1210  C1211   1.350   .     S
C1211  C1218   1.385   .     S
C1211  N1212   1.351   .     S
N1212  C1213   1.350   .     S
C1213  N1214   1.351   .     S
C1215  C3912   1.442   .     S
C1215  C1220   1.434   .     S
C1215  C1216   1.433   .     S
C1216  H1223   1.101   .     S
C1216  C1217   1.368   .     S
C1217  C1218   1.428   .     S
C1217  H1221   1.100   .     S
C1218  C1219   1.428   .     S
C1219  H1222   1.100   .     S
C1219  C1220   1.367   .     S
C1220  H1224   1.101   .     S
C1225  C1233   1.440   .     S
C1225  C1226   1.435   .     S
C1225  C1230   1.435   .     S
C1226  C1227   1.368   .     S
C1226  H1239   1.101   .     S
C1227  H1231   1.100   .     S
C1227  C1228   1.428   .     S
C1228  C1255   1.385   .     S
C1228  C1229   1.428   .     S
C1229  C1230   1.368   .     S
C1229  H1232   1.100   .     S
C1230  H1240   1.101   .     S
C1233  C1234   1.434   .     S
C1233  C1238   1.435   .     S
C1234  C1235   1.367   .     S
C1234  H1241   1.101   .     S
C1235  H1242   1.100   .     S
C1235  C1236   1.428   .     S
C1236  C1237   1.428   .     S
C1236  C1281   1.385   .     S
C1237  C1238   1.368   .     S
C1237  H1243   1.101   .     S
C1238  H1244   1.101   .     S
C1245  H1297   1.100   .     S
C1245  C1250   1.400   .     S
C1245  C1246   1.401   .     S
C1246  C1247   1.385   .     S
C1246  H1259   1.100   .     S
C1247  H1257   1.100   .     S
C1247  C1248   1.428   .     S
C1248  C1249   1.429   .     S
C1248  C1251   1.383   .     S
C1249  H1258   1.099   .     S
C1249  C1250   1.385   .     S
C1250  H1260   1.100   .     S
C1251  N1256   1.352   .     S
C1251  N1252   1.351   .     S
N1252  C1253   1.351   .     S
C1253  C1264   1.382   .     S
C1253  N1254   1.352   .     S
N1254  C1255   1.350   .     S
C1255  N1256   1.351   .     S
C1261  C1266   1.400   .     S
C1261  H1298   1.099   .     S
C1261  C1262   1.401   .     S
C1262  C1263   1.385   .     S
C1262  H1269   1.100   .     S
C1263  C1264   1.429   .     S
C1263  H1267   1.099   .     S
C1264  C1265   1.428   .     S
C1265  C1266   1.385   .     S
C1265  H1268   1.099   .     S
C1266  H1270   1.100   .     S
C1271  H1299   1.099   .     S
C1271  C1276   1.401   .     S
C1271  C1272   1.401   .     S
C1272  H1279   1.099   .     S
C1272  C1273   1.385   .     S
C1273  C1274   1.429   .     S
C1273  H1277   1.099   .     S
C1274  C1275   1.428   .     S
C1274  C1285   1.383   .     S
C1275  H1278   1.099   .     S
C1275  C1276   1.384   .     S
C1276  H1280   1.100   .     S
C1281  N1282   1.351   .     S
C1281  N1286   1.352   .     S
N1282  C1283   1.352   .     S
C1283  C1290   1.384   .     S
C1283  N1284   1.351   .     S
N1284  C1285   1.351   .     S
C1285  N1286   1.352   .     S
C1287  C1288   1.434   .     S
C1287  C1292   1.432   .     S
C1288  H1295   1.100   .     S
C1288  C1289   1.367   .     S
C1289  H1293   1.100   .     S
C1289  C1290   1.427   .     S
C1290  C1291   1.428   .     S
C1291  H1294   1.099   .     S
C1291  C1292   1.368   .     S
C1292  H1296   1.101   .     S
C1300  C1301   1.434   .     S
C1300  C1308   1.441   .     S
C1300  C1305   1.434   .     S
C1301  C1302   1.368   .     S
C1301  H1314   1.101   .     S
C1302  H1306   1.100   .     S
C1302  C1303   1.427   .     S
C1303  C1304   1.427   .     S
C1303  C1330   1.386   .     S
C1304  C1305   1.368   .     S
C1304  H1307   1.100   .     S
C1305  H1315   1.101   .     S
C1308  C1309   1.434   .     S
C1308  C1313   1.435   .     S
C1309  H1316   1.101   .     S
C1309  C1310   1.368   .     S
C1310  H1317   1.100   .     S
C1310  C1311   1.427   .     S
C1311  C1356   1.386   .     S
C1311  C1312   1.428   .     S
C1312  C1313   1.368   .     S
C1312  H1318   1.100   .     S
C1313  H1319   1.101   .     S
C1320  H1372   1.100   .     S
C1320  C1321   1.400   .     S
C1320  C1325   1.401   .     S
C1321  H1334   1.100   .     S
C1321  C1322   1.385   .     S
C1322  H1332   1.099   .     S
C1322  C1323   1.429   .     S
C1323  C1324   1.429   .     S
C1323  C1326   1.382   .     S
C1324  H1333   1.100   .     S
C1324  C1325   1.385   .     S
C1325  H1335   1.100   .     S
C1326  N1327   1.351   .     S
C1326  N1331   1.352   .     S
N1327  C1328   1.350   .     S
C1328  N1329   1.352   .     S
C1328  C1339   1.383   .     S
N1329  C1330   1.350   .     S
C1330  N1331   1.351   .     S
C1336  C1341   1.401   .     S
C1336  H1373   1.099   .     S
C1336  C1337   1.400   .     S
C1337  C1338   1.385   .     S
C1337  H1344   1.100   .     S
C1338  H1342   1.100   .     S
C1338  C1339   1.429   .     S
C1339  C1340   1.428   .     S
C1340  C1341   1.385   .     S
C1340  H1343   1.099   .     S
C1341  H1345   1.099   .     S
C1346  C1351   1.401   .     S
C1346  H1374   1.100   .     S
C1346  C1347   1.401   .     S
C1347  C1348   1.385   .     S
C1347  H1354   1.100   .     S
C1348  C1349   1.428   .     S
C1348  H1352   1.100   .     S
C1349  C1350   1.429   .     S
C1349  C1360   1.382   .     S
C1350  C1351   1.383   .     S
C1350  H1353   1.099   .     S
C1351  H1355   1.100   .     S
C1356  N1361   1.351   .     S
C1356  N1357   1.350   .     S
N1357  C1358   1.351   .     S
C1358  N1359   1.350   .     S
C1358  C1365   1.385   .     S
N1359  C1360   1.351   .     S
C1360  N1361   1.352   .     S
C1362  C1363   1.434   .     S
C1362  C1367   1.435   .     S
C1363  H1370   1.101   .     S
C1363  C1364   1.368   .     S
C1364  C1365   1.427   .     S
C1364  H1368   1.099   .     S
C1365  C1366   1.429   .     S
C1366  H1369   1.100   .     S
C1366  C1367   1.367   .     S
C1367  H1371   1.102   .     S
C1375  C1376   1.435   .     S
C1375  C1383   1.440   .     S
C1375  C1380   1.433   .     S
C1376  C1377   1.368   .     S
C1376  H1389   1.100   .     S
C1377  C1378   1.428   .     S
C1377  H1381   1.099   .     S
C1378  C1405   1.385   .     S
C1378  C1379   1.427   .     S
C1379  C1380   1.367   .     S
C1379  H1382   1.101   .     S
C1380  H1390   1.101   .     S
C1383  C1384   1.433   .     S
C1383  C1388   1.434   .     S
C1384  C1385   1.367   .     S
C1384  H1391   1.101   .     S
C1385  C1386   1.428   .     S
C1385  H1392   1.100   .     S
C1386  C1431   1.385   .     S
C1386  C1387   1.428   .     S
C1387  H1393   1.100   .     S
C1387  C1388   1.367   .     S
C1388  H1394   1.101   .     S
C1395  C1396   1.400   .     S
C1395  C1400   1.401   .     S
C1395  H1447   1.099   .     S
C1396  C1397   1.385   .     S
C1396  H1409   1.099   .     S
C1397  H1407   1.100   .     S
C1397  C1398   1.429   .     S
C1398  C1401   1.383   .     S
C1398  C1399   1.429   .     S
C1399  H1408   1.099   .     S
C1399  C1400   1.384   .     S
C1400  H1410   1.100   .     S
C1401  N1406   1.351   .     S
C1401  N1402   1.350   .     S
N1402  C1403   1.351   .     S
C1403  N1404   1.351   .     S
C1403  C1414   1.383   .     S
N1404  C1405   1.350   .     S
C1405  N1406   1.351   .     S
C1411  H1448   1.099   .     S
C1411  C1416   1.401   .     S
C1411  C1412   1.400   .     S
C1412  H1419   1.101   .     S
C1412  C1413   1.384   .     S
C1413  C1414   1.429   .     S
C1413  H1417   1.099   .     S
C1414  C1415   1.429   .     S
C1415  H1418   1.099   .     S
C1415  C1416   1.384   .     S
C1416  H1420   1.099   .     S
C1421  C1426   1.400   .     S
C1421  H1449   1.099   .     S
C1421  C1422   1.401   .     S
C1422  H1429   1.101   .     S
C1422  C1423   1.384   .     S
C1423  C1424   1.429   .     S
C1423  H1427   1.100   .     S
C1424  C1425   1.429   .     S
C1424  C1435   1.383   .     S
C1425  C1426   1.384   .     S
C1425  H1428   1.099   .     S
C1426  H1430   1.099   .     S
C1431  N1432   1.351   .     S
C1431  N1436   1.352   .     S
N1432  C1433   1.351   .     S
C1433  N1434   1.351   .     S
C1433  C1440   1.385   .     S
N1434  C1435   1.350   .     S
C1435  N1436   1.350   .     S
C1437  C1438   1.433   .     S
C1437  C1442   1.434   .     S
C1438  H1445   1.101   .     S
C1438  C1439   1.368   .     S
C1439  H1443   1.100   .     S
C1439  C1440   1.428   .     S
C1440  C1441   1.427   .     S
C1441  H1444   1.100   .     S
C1441  C1442   1.367   .     S
C1442  H1446   1.101   .     S
C1450  C1455   1.434   .     S
C1450  C1451   1.434   .     S
C1450  C1458   1.440   .     S
C1451  H1464   1.101   .     S
C1451  C1452   1.367   .     S
C1452  H1456   1.100   .     S
C1452  C1453   1.427   .     S
C1453  C1480   1.385   .     S
C1453  C1454   1.427   .     S
C1454  H1457   1.100   .     S
C1454  C1455   1.368   .     S
C1455  H1465   1.100   .     S
C1458  C1463   1.434   .     S
C1458  C1459   1.434   .     S
C1459  C1460   1.367   .     S
C1459  H1466   1.101   .     S
C1460  H1467   1.100   .     S
C1460  C1461   1.428   .     S
C1461  C1462   1.427   .     S
C1461  C1506   1.385   .     S
C1462  C1463   1.368   .     S
C1462  H1468   1.101   .     S
C1463  H1469   1.101   .     S
C1470  H1522   1.099   .     S
C1470  C1475   1.401   .     S
C1470  C1471   1.400   .     S
C1471  C1472   1.384   .     S
C1471  H1484   1.100   .     S
C1472  C1473   1.428   .     S
C1472  H1482   1.099   .     S
C1473  C1476   1.382   .     S
C1473  C1474   1.429   .     S
C1474  C1475   1.385   .     S
C1474  H1483   1.099   .     S
C1475  H1485   1.099   .     S
C1476  N1477   1.351   .     S
C1476  N1481   1.352   .     S
N1477  C1478   1.352   .     S
C1478  C1489   1.383   .     S
C1478  N1479   1.351   .     S
N1479  C1480   1.350   .     S
C1480  N1481   1.350   .     S
C1486  C1487   1.400   .     S
C1486  H1523   1.099   .     S
C1486  C1491   1.401   .     S
C1487  H1494   1.100   .     S
C1487  C1488   1.384   .     S
C1488  H1492   1.100   .     S
C1488  C1489   1.429   .     S
C1489  C1490   1.428   .     S
C1490  H1493   1.100   .     S
C1490  C1491   1.384   .     S
C1491  H1495   1.099   .     S
C1496  H1524   1.100   .     S
C1496  C1497   1.400   .     S
C1496  C1501   1.400   .     S
C1497  C1498   1.385   .     S
C1497  H1504   1.100   .     S
C1498  C1499   1.428   .     S
C1498  H1502   1.099   .     S
C1499  C1500   1.429   .     S
C1499  C1510   1.382   .     S
C1500  H1503   1.100   .     S
C1500  C1501   1.384   .     S
C1501  H1505   1.099   .     S
C1506  N1511   1.351   .     S
C1506  N1507   1.350   .     S
N1507  C1508   1.351   .     S
C1508  N1509   1.351   .     S
C1508  C1515   1.385   .     S
N1509  C1510   1.352   .     S
C1510  N1511   1.352   .     S
C1512  C1517   1.433   .     S
C1512  C1513   1.433   .     S
C1513  C1514   1.368   .     S
C1513  H1520   1.100   .     S
C1514  C1515   1.427   .     S
C1514  H1518   1.100   .     S
C1515  C1516   1.427   .     S
C1516  C1517   1.367   .     S
C1516  H1519   1.100   .     S
C1517  H1521   1.100   .     S
C1525  C1526   1.434   .     S
C1525  C1530   1.433   .     S
C1525  C1533   1.440   .     S
C1526  H1539   1.101   .     S
C1526  C1527   1.367   .     S
C1527  H1531   1.100   .     S
C1527  C1528   1.427   .     S
C1528  C1555   1.385   .     S
C1528  C1529   1.427   .     S
C1529  C1530   1.368   .     S
C1529  H1532   1.100   .     S
C1530  H1540   1.101   .     S
C1533  C1538   1.432   .     S
C1533  C1534   1.435   .     S
C1534  C1535   1.368   .     S
C1534  H1541   1.100   .     S
C1535  C1536   1.427   .     S
C1535  H1542   1.100   .     S
C1536  C1537   1.427   .     S
C1536  C1581   1.384   .     S
C1537  H1543   1.100   .     S
C1537  C1538   1.366   .     S
C1538  H1544   1.101   .     S
C1545  C1546   1.400   .     S
C1545  C1550   1.400   .     S
C1545  H1597   1.099   .     S
C1546  H1559   1.100   .     S
C1546  C1547   1.384   .     S
C1547  C1548   1.429   .     S
C1547  H1557   1.100   .     S
C1548  C1551   1.382   .     S
C1548  C1549   1.428   .     S
C1549  C1550   1.385   .     S
C1549  H1558   1.099   .     S
C1550  H1560   1.100   .     S
C1551  N1556   1.351   .     S
C1551  N1552   1.351   .     S
N1552  C1553   1.351   .     S
C1553  N1554   1.351   .     S
C1553  C1564   1.382   .     S
N1554  C1555   1.350   .     S
C1555  N1556   1.350   .     S
C1561  C1562   1.400   .     S
C1561  H1598   1.100   .     S
C1561  C1566   1.401   .     S
C1562  H1569   1.100   .     S
C1562  C1563   1.385   .     S
C1563  H1567   1.100   .     S
C1563  C1564   1.428   .     S
C1564  C1565   1.429   .     S
C1565  C1566   1.385   .     S
C1565  H1568   1.099   .     S
C1566  H1570   1.100   .     S
C1571  C1572   1.400   .     S
C1571  H1599   1.099   .     S
C1571  C1576   1.400   .     S
C1572  H1579   1.100   .     S
C1572  C1573   1.385   .     S
C1573  H1577   1.100   .     S
C1573  C1574   1.429   .     S
C1574  C1575   1.429   .     S
C1574  C1585   1.382   .     S
C1575  C1576   1.385   .     S
C1575  H1578   1.098   .     S
C1576  H1580   1.100   .     S
C1581  N1582   1.349   .     S
C1581  N1586   1.350   .     S
N1582  C1583   1.349   .     S
C1583  N1584   1.349   .     S
C1583  C1590   1.385   .     S
N1584  C1585   1.353   .     S
C1585  N1586   1.354   .     S
C1587  C1588   1.433   .     S
C1587  C1592   1.436   .     S
C1588  C1589   1.365   .     S
C1588  H1595   1.102   .     S
C1589  C1590   1.428   .     S
C1589  H1593   1.099   .     S
C1590  C1591   1.427   .     S
C1591  C1592   1.368   .     S
C1591  H1594   1.100   .     S
C1592  H1596   1.102   .     S
C1600  C1608   1.434   .     S
C1600  C1601   1.436   .     S
C1600  C1605   1.436   .     S
C1601  C1602   1.368   .     S
C1601  H1614   1.101   .     S
C1602  H1606   1.100   .     S
C1602  C1603   1.427   .     S
C1603  C1630   1.385   .     S
C1603  C1604   1.429   .     S
C1604  H1607   1.100   .     S
C1604  C1605   1.367   .     S
C1605  H1615   1.101   .     S
C1608  C1613   1.436   .     S
C1608  C1609   1.436   .     S
C1609  C1610   1.368   .     S
C1609  H1616   1.101   .     S
C1610  C1611   1.426   .     S
C1610  H1617   1.099   .     S
C1611  C1656   1.385   .     S
C1611  C1612   1.429   .     S
C1612  C1613   1.366   .     S
C1612  H1618   1.100   .     S
C1613  H1619   1.101   .     S
C1620  C1621   1.400   .     S
C1620  H1672   1.100   .     S
C1620  C1625   1.401   .     S
C1621  H1634   1.098   .     S
C1621  C1622   1.383   .     S
C1622  C1623   1.429   .     S
C1622  H1632   1.099   .     S
C1623  C1624   1.428   .     S
C1623  C1626   1.382   .     S
C1624  C1625   1.385   .     S
C1624  H1633   1.098   .     S
C1625  H1635   1.100   .     S
C1626  N1627   1.350   .     S
C1626  N1631   1.350   .     S
N1627  C1628   1.352   .     S
C1628  N1629   1.353   .     S
C1628  C1639   1.383   .     S
N1629  C1630   1.350   .     S
C1630  N1631   1.350   .     S
C1636  C1641   1.400   .     S
C1636  C1637   1.400   .     S
C1636  H1673   1.100   .     S
C1637  C1638   1.385   .     S
C1637  H1644   1.100   .     S
C1638  C1639   1.430   .     S
C1638  H1642   1.099   .     S
C1639  C1640   1.428   .     S
C1640  H1643   1.099   .     S
C1640  C1641   1.385   .     S
C1641  H1645   1.100   .     S
C1646  H1674   1.099   .     S
C1646  C1651   1.400   .     S
C1646  C1647   1.401   .     S
C1647  H1654   1.099   .     S
C1647  C1648   1.386   .     S
C1648  H1652   1.099   .     S
C1648  C1649   1.429   .     S
C1649  C1660   1.382   .     S
C1649  C1650   1.430   .     S
C1650  C1651   1.384   .     S
C1650  H1653   1.100   .     S
C1651  H1655   1.100   .     S
C1656  N1661   1.349   .     S
C1656  N1657   1.347   .     S
N1657  C1658   1.351   .     S
C1658  C1665   1.385   .     S
C1658  N1659   1.350   .     S
N1659  C1660   1.355   .     S
C1660  N1661   1.353   .     S
C1662  C1663   1.430   .     S
C1662  C1667   1.434   .     S
C1663  C1664   1.365   .     S
C1663  H1670   1.101   .     S
C1664  H1668   1.100   .     S
C1664  C1665   1.428   .     S
C1665  C1666   1.426   .     S
C1666  H1669   1.100   .     S
C1666  C1667   1.371   .     S
C1667  H1671   1.099   .     S
C1675  C1683   1.443   .     S
C1675  C1680   1.434   .     S
C1675  C1676   1.432   .     S
C1676  H1689   1.101   .     S
C1676  C1677   1.367   .     S
C1677  C1678   1.427   .     S
C1677  H1681   1.099   .     S
C1678  C1679   1.427   .     S
C1678  C1705   1.384   .     S
C1679  H1682   1.100   .     S
C1679  C1680   1.369   .     S
C1680  H1690   1.100   .     S
C1683  C1688   1.432   .     S
C1683  C1684   1.434   .     S
C1684  H1691   1.100   .     S
C1684  C1685   1.369   .     S
C1685  C1686   1.427   .     S
C1685  H1692   1.099   .     S
C1686  C1731   1.385   .     S
C1686  C1687   1.427   .     S
C1687  H1693   1.100   .     S
C1687  C1688   1.367   .     S
C1688  H1694   1.101   .     S
C1695  H1747   1.100   .     S
C1695  C1700   1.400   .     S
C1695  C1696   1.401   .     S
C1696  H1709   1.100   .     S
C1696  C1697   1.385   .     S
C1697  C1698   1.428   .     S
C1697  H1707   1.100   .     S
C1698  C1699   1.429   .     S
C1698  C1701   1.382   .     S
C1699  C1700   1.384   .     S
C1699  H1708   1.098   .     S
C1700  H1710   1.100   .     S
C1701  N1706   1.352   .     S
C1701  N1702   1.351   .     S
N1702  C1703   1.350   .     S
C1703  C1714   1.382   .     S
C1703  N1704   1.351   .     S
N1704  C1705   1.350   .     S
C1705  N1706   1.350   .     S
C1711  H1748   1.100   .     S
C1711  C1712   1.401   .     S
C1711  C1716   1.401   .     S
C1712  H1719   1.100   .     S
C1712  C1713   1.385   .     S
C1713  H1717   1.099   .     S
C1713  C1714   1.428   .     S
C1714  C1715   1.428   .     S
C1715  H1718   1.100   .     S
C1715  C1716   1.384   .     S
C1716  H1720   1.099   .     S
C1721  C1726   1.401   .     S
C1721  C1722   1.400   .     S
C1721  H1749   1.099   .     S
C1722  H1729   1.100   .     S
C1722  C1723   1.384   .     S
C1723  C1724   1.429   .     S
C1723  H1727   1.099   .     S
C1724  C1725   1.429   .     S
C1724  C1735   1.382   .     S
C1725  H1728   1.099   .     S
C1725  C1726   1.385   .     S
C1726  H1730   1.100   .     S
C1731  N1732   1.350   .     S
C1731  N1736   1.350   .     S
N1732  C1733   1.350   .     S
C1733  C1740   1.385   .     S
C1733  N1734   1.350   .     S
N1734  C1735   1.353   .     S
C1735  N1736   1.351   .     S
C1737  C1738   1.433   .     S
C1737  C1742   1.437   .     S
C1738  C1739   1.367   .     S
C1738  H1745   1.102   .     S
C1739  H1743   1.100   .     S
C1739  C1740   1.427   .     S
C1740  C1741   1.429   .     S
C1741  C1742   1.370   .     S
C1741  H1744   1.100   .     S
C1742  H1746   1.101   .     S
C1750  C1758   1.438   .     S
C1750  C1751   1.435   .     S
C1750  C1755   1.434   .     S
C1751  C1752   1.370   .     S
C1751  H1764   1.101   .     S
C1752  H1756   1.099   .     S
C1752  C1753   1.428   .     S
C1753  C1754   1.428   .     S
C1753  C1780   1.386   .     S
C1754  C1755   1.367   .     S
C1754  H1757   1.100   .     S
C1755  H1765   1.101   .     S
C1758  C1763   1.436   .     S
C1758  C1759   1.435   .     S
C1759  C1760   1.367   .     S
C1759  H1766   1.101   .     S
C1760  C1761   1.429   .     S
C1760  H1767   1.100   .     S
C1761  C1806   1.386   .     S
C1761  C1762   1.428   .     S
C1762  C1763   1.370   .     S
C1762  H1768   1.100   .     S
C1763  H1769   1.100   .     S
C1770  H1822   1.100   .     S
C1770  C1775   1.400   .     S
C1770  C1771   1.400   .     S
C1771  H1784   1.100   .     S
C1771  C1772   1.385   .     S
C1772  H1782   1.100   .     S
C1772  C1773   1.428   .     S
C1773  C1776   1.384   .     S
C1773  C1774   1.428   .     S
C1774  H1783   1.099   .     S
C1774  C1775   1.385   .     S
C1775  H1785   1.100   .     S
C1776  N1781   1.350   .     S
C1776  N1777   1.350   .     S
N1777  C1778   1.351   .     S
C1778  N1779   1.353   .     S
C1778  C1789   1.383   .     S
N1779  C1780   1.351   .     S
C1780  N1781   1.352   .     S
C1786  C1791   1.400   .     S
C1786  H1823   1.099   .     S
C1786  C1787   1.401   .     S
C1787  H1794   1.100   .     S
C1787  C1788   1.384   .     S
C1788  H1792   1.100   .     S
C1788  C1789   1.429   .     S
C1789  C1790   1.428   .     S
C1790  C1791   1.385   .     S
C1790  H1793   1.099   .     S
C1791  H1795   1.099   .     S
C1796  C1797   1.401   .     S
C1796  C1801   1.400   .     S
C1796  H1824   1.100   .     S
C1797  C1798   1.384   .     S
C1797  H1804   1.100   .     S
C1798  H1802   1.100   .     S
C1798  C1799   1.429   .     S
C1799  C1810   1.384   .     S
C1799  C1800   1.428   .     S
C1800  H1803   1.100   .     S
C1800  C1801   1.384   .     S
C1801  H1805   1.100   .     S
C1806  N1811   1.351   .     S
C1806  N1807   1.353   .     S
N1807  C1808   1.352   .     S
C1808  N1809   1.353   .     S
C1808  C1815   1.386   .     S
N1809  C1810   1.349   .     S
C1810  N1811   1.351   .     S
C1812  C1813   1.443   .     S
C1812  C1817   1.444   .     S
C1813  H1820   1.101   .     S
C1813  C1814   1.369   .     S
C1814  H1818   1.100   .     S
C1814  C1815   1.428   .     S
C1815  C1816   1.429   .     S
C1816  C1817   1.366   .     S
C1816  H1819   1.099   .     S
C1817  H1821   1.102   .     S
C1825  C1833   1.437   .     S
C1825  C1830   1.435   .     S
C1825  C1826   1.434   .     S
C1826  H1839   1.101   .     S
C1826  C1827   1.368   .     S
C1827  C1828   1.428   .     S
C1827  H1831   1.100   .     S
C1828  C1855   1.384   .     S
C1828  C1829   1.428   .     S
C1829  C1830   1.367   .     S
C1829  H1832   1.100   .     S
C1830  H1840   1.101   .     S
C1833  C1838   1.435   .     S
C1833  C1834   1.435   .     S
C1834  C1835   1.367   .     S
C1834  H1841   1.101   .     S
C1835  H1842   1.100   .     S
C1835  C1836   1.428   .     S
C1836  C1881   1.386   .     S
C1836  C1837   1.428   .     S
C1837  C1838   1.367   .     S
C1837  H1843   1.100   .     S
C1838  H1844   1.101   .     S
C1845  C1846   1.400   .     S
C1845  C1850   1.401   .     S
C1845  H1897   1.099   .     S
C1846  H1859   1.098   .     S
C1846  C1847   1.384   .     S
C1847  H1857   1.099   .     S
C1847  C1848   1.429   .     S
C1848  C1849   1.428   .     S
C1848  C1851   1.382   .     S
C1849  H1858   1.099   .     S
C1849  C1850   1.386   .     S
C1850  H1860   1.100   .     S
C1851  N1856   1.351   .     S
C1851  N1852   1.351   .     S
N1852  C1853   1.352   .     S
C1853  N1854   1.351   .     S
C1853  C1864   1.383   .     S
N1854  C1855   1.351   .     S
C1855  N1856   1.350   .     S
C1861  H1898   1.099   .     S
C1861  C1866   1.400   .     S
C1861  C1862   1.401   .     S
C1862  H1869   1.100   .     S
C1862  C1863   1.385   .     S
C1863  C1864   1.429   .     S
C1863  H1867   1.099   .     S
C1864  C1865   1.428   .     S
C1865  H1868   1.099   .     S
C1865  C1866   1.385   .     S
C1866  H1870   1.099   .     S
C1871  C1876   1.400   .     S
C1871  C1872   1.400   .     S
C1871  H1899   1.100   .     S
C1872  H1879   1.099   .     S
C1872  C1873   1.385   .     S
C1873  C1874   1.428   .     S
C1873  H1877   1.100   .     S
C1874  C1885   1.382   .     S
C1874  C1875   1.429   .     S
C1875  H1878   1.099   .     S
C1875  C1876   1.384   .     S
C1876  H1880   1.099   .     S
C1881  N1886   1.350   .     S
C1881  N1882   1.351   .     S
N1882  C1883   1.351   .     S
C1883  C1890   1.385   .     S
C1883  N1884   1.352   .     S
N1884  C1885   1.351   .     S
C1885  N1886   1.351   .     S
C1887  C1892   1.434   .     S
C1887  C1888   1.433   .     S
C1888  C1889   1.368   .     S
C1888  H1895   1.101   .     S
C1889  C1890   1.427   .     S
C1889  H1893   1.100   .     S
C1890  C1891   1.428   .     S
C1891  H1894   1.100   .     S
C1891  C1892   1.368   .     S
C1892  H1896   1.101   .     S
C1900  C1908   1.442   .     S
C1900  C1905   1.434   .     S
C1900  C1901   1.434   .     S
C1901  H1914   1.100   .     S
C1901  C1902   1.368   .     S
C1902  H1906   1.100   .     S
C1902  C1903   1.427   .     S
C1903  C1930   1.385   .     S
C1903  C1904   1.428   .     S
C1904  C1905   1.368   .     S
C1904  H1907   1.099   .     S
C1905  H1915   1.101   .     S
C1908  C1913   1.434   .     S
C1908  C1909   1.434   .     S
C1909  C1910   1.368   .     S
C1909  H1916   1.101   .     S
C1910  C1911   1.427   .     S
C1910  H1917   1.100   .     S
C1911  C1912   1.428   .     S
C1911  C1956   1.386   .     S
C1912  C1913   1.368   .     S
C1912  H1918   1.100   .     S
C1913  H1919   1.102   .     S
C1920  C1925   1.400   .     S
C1920  C1921   1.401   .     S
C1920  H1972   1.100   .     S
C1921  C1922   1.384   .     S
C1921  H1934   1.100   .     S
C1922  H1932   1.098   .     S
C1922  C1923   1.429   .     S
C1923  C1926   1.383   .     S
C1923  C1924   1.428   .     S
C1924  H1933   1.099   .     S
C1924  C1925   1.385   .     S
C1925  H1935   1.100   .     S
C1926  N1931   1.352   .     S
C1926  N1927   1.351   .     S
N1927  C1928   1.351   .     S
C1928  N1929   1.352   .     S
C1928  C1939   1.382   .     S
N1929  C1930   1.350   .     S
C1930  N1931   1.351   .     S
C1936  H1973   1.100   .     S
C1936  C1937   1.401   .     S
C1936  C1941   1.400   .     S
C1937  C1938   1.385   .     S
C1937  H1944   1.099   .     S
C1938  H1942   1.099   .     S
C1938  C1939   1.429   .     S
C1939  C1940   1.429   .     S
C1940  H1943   1.099   .     S
C1940  C1941   1.384   .     S
C1941  H1945   1.100   .     S
C1946  C1951   1.401   .     S
C1946  C1947   1.400   .     S
C1946  H1974   1.099   .     S
C1947  C1948   1.385   .     S
C1947  H1954   1.100   .     S
C1948  C1949   1.429   .     S
C1948  H1952   1.100   .     S
C1949  C1950   1.429   .     S
C1949  C1960   1.383   .     S
C1950  H1953   1.099   .     S
C1950  C1951   1.384   .     S
C1951  H1955   1.099   .     S
C1956  N1957   1.350   .     S
C1956  N1961   1.352   .     S
N1957  C1958   1.351   .     S
C1958  C1965   1.385   .     S
C1958  N1959   1.351   .     S
N1959  C1960   1.352   .     S
C1960  N1961   1.352   .     S
C1962  C1963   1.434   .     S
C1962  C1967   1.434   .     S
C1963  H1970   1.101   .     S
C1963  C1964   1.367   .     S
C1964  C1965   1.428   .     S
C1964  H1968   1.100   .     S
C1965  C1966   1.428   .     S
C1966  C1967   1.368   .     S
C1966  H1969   1.100   .     S
C1967  H1971   1.100   .     S
C1975  C1983   1.441   .     S
C1975  C1976   1.433   .     S
C1975  C1980   1.434   .     S
C1976  C1977   1.368   .     S
C1976  H1989   1.101   .     S
C1977  H1981   1.100   .     S
C1977  C1978   1.427   .     S
C1978  C2005   1.384   .     S
C1978  C1979   1.427   .     S
C1979  C1980   1.367   .     S
C1979  H1982   1.100   .     S
C1980  H1990   1.101   .     S
C1983  C1984   1.433   .     S
C1983  C1988   1.433   .     S
C1984  H1991   1.101   .     S
C1984  C1985   1.367   .     S
C1985  H1992   1.100   .     S
C1985  C1986   1.428   .     S
C1986  C2031   1.385   .     S
C1986  C1987   1.428   .     S
C1987  H1993   1.100   .     S
C1987  C1988   1.367   .     S
C1988  H1994   1.102   .     S
C1995  H2047   1.099   .     S
C1995  C2000   1.401   .     S
C1995  C1996   1.400   .     S
C1996  C1997   1.384   .     S
C1996  H2009   1.100   .     S
C1997  C1998   1.428   .     S
C1997  H2007   1.100   .     S
C1998  C2001   1.382   .     S
C1998  C1999   1.429   .     S
C1999  C2000   1.385   .     S
C1999  H2008   1.100   .     S
C2000  H2010   1.100   .     S
C2001  N2002   1.351   .     S
C2001  N2006   1.351   .     S
N2002  C2003   1.351   .     S
C2003  C2014   1.382   .     S
C2003  N2004   1.351   .     S
N2004  C2005   1.350   .     S
C2005  N2006   1.350   .     S
C2011  H2048   1.100   .     S
C2011  C2016   1.400   .     S
C2011  C2012   1.401   .     S
C2012  H2019   1.100   .     S
C2012  C2013   1.384   .     S
C2013  H2017   1.099   .     S
C2013  C2014   1.429   .     S
C2014  C2015   1.428   .     S
C2015  C2016   1.384   .     S
C2015  H2018   1.099   .     S
C2016  H2020   1.100   .     S
C2021  H2049   1.099   .     S
C2021  C2026   1.401   .     S
C2021  C2022   1.401   .     S
C2022  H2029   1.099   .     S
C2022  C2023   1.384   .     S
C2023  H2027   1.099   .     S
C2023  C2024   1.428   .     S
C2024  C2035   1.383   .     S
C2024  C2025   1.429   .     S
C2025  H2028   1.100   .     S
C2025  C2026   1.384   .     S
C2026  H2030   1.100   .     S
C2031  N2036   1.351   .     S
C2031  N2032   1.352   .     S
N2032  C2033   1.350   .     S
C2033  C2040   1.386   .     S
C2033  N2034   1.351   .     S
N2034  C2035   1.350   .     S
C2035  N2036   1.352   .     S
C2037  C2042   1.431   .     S
C2037  C2038   1.431   .     S
C2038  H2045   1.100   .     S
C2038  C2039   1.368   .     S
C2039  H2043   1.099   .     S
C2039  C2040   1.427   .     S
C2040  C2041   1.427   .     S
C2041  H2044   1.099   .     S
C2041  C2042   1.367   .     S
C2042  H2046   1.100   .     S
C2050  C2055   1.434   .     S
C2050  C2058   1.439   .     S
C2050  C2051   1.435   .     S
C2051  H2064   1.101   .     S
C2051  C2052   1.367   .     S
C2052  C2053   1.428   .     S
C2052  H2056   1.100   .     S
C2053  C2080   1.385   .     S
C2053  C2054   1.427   .     S
C2054  H2057   1.100   .     S
C2054  C2055   1.367   .     S
C2055  H2065   1.101   .     S
C2058  C2059   1.434   .     S
C2058  C2063   1.435   .     S
C2059  H2066   1.100   .     S
C2059  C2060   1.367   .     S
C2060  H2067   1.100   .     S
C2060  C2061   1.429   .     S
C2061  C2106   1.385   .     S
C2061  C2062   1.427   .     S
C2062  H2068   1.100   .     S
C2062  C2063   1.368   .     S
C2063  H2069   1.101   .     S
C2070  H2122   1.099   .     S
C2070  C2071   1.401   .     S
C2070  C2075   1.401   .     S
C2071  H2084   1.099   .     S
C2071  C2072   1.384   .     S
C2072  C2073   1.429   .     S
C2072  H2082   1.100   .     S
C2073  C2074   1.429   .     S
C2073  C2076   1.382   .     S
C2074  C2075   1.385   .     S
C2074  H2083   1.099   .     S
C2075  H2085   1.099   .     S
C2076  N2077   1.351   .     S
C2076  N2081   1.352   .     S
N2077  C2078   1.351   .     S
C2078  C2089   1.382   .     S
C2078  N2079   1.351   .     S
N2079  C2080   1.350   .     S
C2080  N2081   1.351   .     S
C2086  C2091   1.401   .     S
C2086  C2087   1.400   .     S
C2086  H2123   1.099   .     S
C2087  H2094   1.100   .     S
C2087  C2088   1.385   .     S
C2088  H2092   1.100   .     S
C2088  C2089   1.428   .     S
C2089  C2090   1.429   .     S
C2090  H2093   1.099   .     S
C2090  C2091   1.384   .     S
C2091  H2095   1.100   .     S
C2096  C2101   1.401   .     S
C2096  C2097   1.401   .     S
C2096  H2124   1.099   .     S
C2097  H2104   1.099   .     S
C2097  C2098   1.385   .     S
C2098  C2099   1.428   .     S
C2098  H2102   1.099   .     S
C2099  C2100   1.428   .     S
C2099  C2110   1.383   .     S
C2100  H2103   1.099   .     S
C2100  C2101   1.384   .     S
C2101  H2105   1.099   .     S
C2106  N2107   1.352   .     S
C2106  N2111   1.351   .     S
N2107  C2108   1.351   .     S
C2108  C2115   1.385   .     S
C2108  N2109   1.351   .     S
N2109  C2110   1.350   .     S
C2110  N2111   1.350   .     S
C2112  C2113   1.432   .     S
C2112  C2117   1.433   .     S
C2113  C2114   1.369   .     S
C2113  H2120   1.100   .     S
C2114  C2115   1.428   .     S
C2114  H2118   1.100   .     S
C2115  C2116   1.428   .     S
C2116  H2119   1.100   .     S
C2116  C2117   1.367   .     S
C2117  H2121   1.101   .     S
C2125  C2133   1.439   .     S
C2125  C2126   1.435   .     S
C2125  C2130   1.434   .     S
C2126  C2127   1.368   .     S
C2126  H2139   1.100   .     S
C2127  H2131   1.100   .     S
C2127  C2128   1.428   .     S
C2128  C2155   1.385   .     S
C2128  C2129   1.428   .     S
C2129  C2130   1.368   .     S
C2129  H2132   1.099   .     S
C2130  H2140   1.101   .     S
C2133  C2138   1.435   .     S
C2133  C2134   1.434   .     S
C2134  H2141   1.101   .     S
C2134  C2135   1.368   .     S
C2135  H2142   1.100   .     S
C2135  C2136   1.428   .     S
C2136  C2137   1.428   .     S
C2136  C2181   1.385   .     S
C2137  H2143   1.100   .     S
C2137  C2138   1.367   .     S
C2138  H2144   1.102   .     S
C2145  C2150   1.401   .     S
C2145  C2146   1.401   .     S
C2145  H2197   1.099   .     S
C2146  H2159   1.100   .     S
C2146  C2147   1.384   .     S
C2147  C2148   1.429   .     S
C2147  H2157   1.099   .     S
C2148  C2149   1.429   .     S
C2148  C2151   1.382   .     S
C2149  H2158   1.099   .     S
C2149  C2150   1.384   .     S
C2150  H2160   1.100   .     S
C2151  N2152   1.351   .     S
C2151  N2156   1.352   .     S
N2152  C2153   1.352   .     S
C2153  C2164   1.382   .     S
C2153  N2154   1.352   .     S
N2154  C2155   1.351   .     S
C2155  N2156   1.350   .     S
C2161  H2198   1.099   .     S
C2161  C2166   1.401   .     S
C2161  C2162   1.400   .     S
C2162  H2169   1.100   .     S
C2162  C2163   1.384   .     S
C2163  H2167   1.099   .     S
C2163  C2164   1.429   .     S
C2164  C2165   1.429   .     S
C2165  H2168   1.100   .     S
C2165  C2166   1.384   .     S
C2166  H2170   1.100   .     S
C2171  C2172   1.400   .     S
C2171  H2199   1.099   .     S
C2171  C2176   1.400   .     S
C2172  H2179   1.100   .     S
C2172  C2173   1.385   .     S
C2173  C2174   1.429   .     S
C2173  H2177   1.099   .     S
C2174  C2175   1.429   .     S
C2174  C2185   1.383   .     S
C2175  C2176   1.384   .     S
C2175  H2178   1.099   .     S
C2176  H2180   1.100   .     S
C2181  N2186   1.350   .     S
C2181  N2182   1.351   .     S
N2182  C2183   1.351   .     S
C2183  N2184   1.351   .     S
C2183  C2190   1.386   .     S
N2184  C2185   1.351   .     S
C2185  N2186   1.351   .     S
C2187  C2192   1.434   .     S
C2187  C2188   1.433   .     S
C2188  H2195   1.100   .     S
C2188  C2189   1.368   .     S
C2189  H2193   1.100   .     S
C2189  C2190   1.428   .     S
C2190  C2191   1.427   .     S
C2191  H2194   1.099   .     S
C2191  C2192   1.368   .     S
C2192  H2196   1.100   .     S
C2200  C2205   1.434   .     S
C2200  C2208   1.440   .     S
C2200  C2201   1.434   .     S
C2201  C2202   1.368   .     S
C2201  H2214   1.101   .     S
C2202  C2203   1.428   .     S
C2202  H2206   1.099   .     S
C2203  C2204   1.427   .     S
C2203  C2230   1.384   .     S
C2204  H2207   1.100   .     S
C2204  C2205   1.368   .     S
C2205  H2215   1.101   .     S
C2208  C2213   1.435   .     S
C2208  C2209   1.434   .     S
C2209  C2210   1.367   .     S
C2209  H2216   1.101   .     S
C2210  C2211   1.427   .     S
C2210  H2217   1.100   .     S
C2211  C2256   1.385   .     S
C2211  C2212   1.428   .     S
C2212  H2218   1.100   .     S
C2212  C2213   1.368   .     S
C2213  H2219   1.101   .     S
C2220  C2225   1.400   .     S
C2220  H2272   1.098   .     S
C2220  C2221   1.401   .     S
C2221  H2234   1.100   .     S
C2221  C2222   1.384   .     S
C2222  H2232   1.099   .     S
C2222  C2223   1.429   .     S
C2223  C2224   1.428   .     S
C2223  C2226   1.383   .     S
C2224  C2225   1.385   .     S
C2224  H2233   1.100   .     S
C2225  H2235   1.099   .     S
C2226  N2227   1.350   .     S
C2226  N2231   1.352   .     S
N2227  C2228   1.352   .     S
C2228  N2229   1.352   .     S
C2228  C2239   1.382   .     S
N2229  C2230   1.351   .     S
C2230  N2231   1.350   .     S
C2236  C2237   1.401   .     S
C2236  C2241   1.401   .     S
C2236  H2273   1.099   .     S
C2237  C2238   1.385   .     S
C2237  H2244   1.100   .     S
C2238  H2242   1.099   .     S
C2238  C2239   1.429   .     S
C2239  C2240   1.429   .     S
C2240  C2241   1.384   .     S
C2240  H2243   1.099   .     S
C2241  H2245   1.100   .     S
C2246  C2247   1.401   .     S
C2246  H2274   1.099   .     S
C2246  C2251   1.401   .     S
C2247  C2248   1.384   .     S
C2247  H2254   1.100   .     S
C2248  H2252   1.099   .     S
C2248  C2249   1.429   .     S
C2249  C2250   1.428   .     S
C2249  C2260   1.383   .     S
C2250  C2251   1.384   .     S
C2250  H2253   1.099   .     S
C2251  H2255   1.099   .     S
C2256  N2257   1.351   .     S
C2256  N2261   1.351   .     S
N2257  C2258   1.352   .     S
C2258  C2265   1.385   .     S
C2258  N2259   1.351   .     S
N2259  C2260   1.351   .     S
C2260  N2261   1.351   .     S
C2262  C2267   1.435   .     S
C2262  C2263   1.433   .     S
C2263  C2264   1.368   .     S
C2263  H2270   1.101   .     S
C2264  C2265   1.427   .     S
C2264  H2268   1.099   .     S
C2265  C2266   1.429   .     S
C2266  C2267   1.367   .     S
C2266  H2269   1.100   .     S
C2267  H2271   1.100   .     S
C2275  C2280   1.433   .     S
C2275  C2283   1.441   .     S
C2275  C2276   1.434   .     S
C2276  H2289   1.101   .     S
C2276  C2277   1.368   .     S
C2277  C2278   1.429   .     S
C2277  H2281   1.100   .     S
C2278  C2305   1.385   .     S
C2278  C2279   1.427   .     S
C2279  H2282   1.101   .     S
C2279  C2280   1.367   .     S
C2280  H2290   1.101   .     S
C2283  C2288   1.435   .     S
C2283  C2284   1.434   .     S
C2284  C2285   1.367   .     S
C2284  H2291   1.101   .     S
C2285  C2286   1.429   .     S
C2285  H2292   1.100   .     S
C2286  C2331   1.385   .     S
C2286  C2287   1.427   .     S
C2287  H2293   1.099   .     S
C2287  C2288   1.368   .     S
C2288  H2294   1.101   .     S
C2295  C2300   1.401   .     S
C2295  H2347   1.100   .     S
C2295  C2296   1.400   .     S
C2296  H2309   1.099   .     S
C2296  C2297   1.385   .     S
C2297  H2307   1.099   .     S
C2297  C2298   1.429   .     S
C2298  C2299   1.429   .     S
C2298  C2301   1.382   .     S
C2299  H2308   1.100   .     S
C2299  C2300   1.385   .     S
C2300  H2310   1.099   .     S
C2301  N2306   1.352   .     S
C2301  N2302   1.351   .     S
N2302  C2303   1.350   .     S
C2303  N2304   1.352   .     S
C2303  C2314   1.383   .     S
N2304  C2305   1.351   .     S
C2305  N2306   1.350   .     S
C2311  C2312   1.401   .     S
C2311  C2316   1.400   .     S
C2311  H2348   1.100   .     S
C2312  H2319   1.100   .     S
C2312  C2313   1.385   .     S
C2313  H2317   1.099   .     S
C2313  C2314   1.429   .     S
C2314  C2315   1.428   .     S
C2315  H2318   1.100   .     S
C2315  C2316   1.384   .     S
C2316  H2320   1.100   .     S
C2321  C2322   1.400   .     S
C2321  C2326   1.400   .     S
C2321  H2349   1.100   .     S
C2322  H2329   1.100   .     S
C2322  C2323   1.384   .     S
C2323  H2327   1.099   .     S
C2323  C2324   1.429   .     S
C2324  C2325   1.428   .     S
C2324  C2335   1.383   .     S
C2325  H2328   1.100   .     S
C2325  C2326   1.385   .     S
C2326  H2330   1.100   .     S
C2331  N2332   1.352   .     S
C2331  N2336   1.351   .     S
N2332  C2333   1.351   .     S
C2333  C2340   1.385   .     S
C2333  N2334   1.351   .     S
N2334  C2335   1.351   .     S
C2335  N2336   1.350   .     S
C2337  C2338   1.435   .     S
C2337  C2342   1.433   .     S
C2338  C2339   1.369   .     S
C2338  H2345   1.100   .     S
C2339  H2343   1.099   .     S
C2339  C2340   1.428   .     S
C2340  C2341   1.428   .     S
C2341  C2342   1.367   .     S
C2341  H2344   1.100   .     S
C2342  H2346   1.101   .     S
C2350  C2358   1.444   .     S
C2350  C2351   1.435   .     S
C2350  C2355   1.432   .     S
C2351  H2364   1.100   .     S
C2351  C2352   1.366   .     S
C2352  H2356   1.100   .     S
C2352  C2353   1.427   .     S
C2353  C2380   1.385   .     S
C2353  C2354   1.428   .     S
C2354  H2357   1.099   .     S
C2354  C2355   1.369   .     S
C2355  H2365   1.100   .     S
C2358  C2359   1.435   .     S
C2358  C2363   1.431   .     S
C2359  H2366   1.100   .     S
C2359  C2360   1.369   .     S
C2360  H2367   1.100   .     S
C2360  C2361   1.427   .     S
C2361  C2362   1.427   .     S
C2361  C2406   1.384   .     S
C2362  H2368   1.099   .     S
C2362  C2363   1.368   .     S
C2363  H2369   1.101   .     S
C2370  C2375   1.400   .     S
C2370  H2422   1.100   .     S
C2370  C2371   1.401   .     S
C2371  H2384   1.100   .     S
C2371  C2372   1.385   .     S
C2372  H2382   1.100   .     S
C2372  C2373   1.428   .     S
C2373  C2376   1.382   .     S
C2373  C2374   1.429   .     S
C2374  H2383   1.099   .     S
C2374  C2375   1.385   .     S
C2375  H2385   1.099   .     S
C2376  N2377   1.352   .     S
C2376  N2381   1.352   .     S
N2377  C2378   1.351   .     S
C2378  C2389   1.382   .     S
C2378  N2379   1.350   .     S
N2379  C2380   1.350   .     S
C2380  N2381   1.351   .     S
C2386  C2387   1.401   .     S
C2386  H2423   1.099   .     S
C2386  C2391   1.400   .     S
C2387  H2394   1.099   .     S
C2387  C2388   1.385   .     S
C2388  H2392   1.099   .     S
C2388  C2389   1.429   .     S
C2389  C2390   1.428   .     S
C2390  H2393   1.099   .     S
C2390  C2391   1.385   .     S
C2391  H2395   1.099   .     S
C2396  C2401   1.400   .     S
C2396  H2424   1.099   .     S
C2396  C2397   1.401   .     S
C2397  H2404   1.100   .     S
C2397  C2398   1.384   .     S
C2398  H2402   1.099   .     S
C2398  C2399   1.429   .     S
C2399  C2410   1.381   .     S
C2399  C2400   1.429   .     S
C2400  H2403   1.099   .     S
C2400  C2401   1.385   .     S
C2401  H2405   1.100   .     S
C2406  N2411   1.351   .     S
C2406  N2407   1.350   .     S
N2407  C2408   1.351   .     S
C2408  C2415   1.384   .     S
C2408  N2409   1.350   .     S
N2409  C2410   1.352   .     S
C2410  N2411   1.351   .     S
C2412  C2417   1.433   .     S
C2412  C2413   1.432   .     S
C2413  H2420   1.101   .     S
C2413  C2414   1.367   .     S
C2414  H2418   1.100   .     S
C2414  C2415   1.426   .     S
C2415  C2416   1.427   .     S
C2416  H2419   1.100   .     S
C2416  C2417   1.367   .     S
C2417  H2421   1.101   .     S
C2425  C2426   1.434   .     S
C2425  C2430   1.433   .     S
C2425  C2433   1.439   .     S
C2426  C2427   1.367   .     S
C2426  H2439   1.100   .     S
C2427  H2431   1.100   .     S
C2427  C2428   1.428   .     S
C2428  C2455   1.384   .     S
C2428  C2429   1.427   .     S
C2429  C2430   1.367   .     S
C2429  H2432   1.100   .     S
C2430  H2440   1.101   .     S
C2433  C2438   1.434   .     S
C2433  C2434   1.435   .     S
C2434  C2435   1.367   .     S
C2434  H2441   1.100   .     S
C2435  H2442   1.099   .     S
C2435  C2436   1.428   .     S
C2436  C2437   1.428   .     S
C2436  C2481   1.384   .     S
C2437  C2438   1.367   .     S
C2437  H2443   1.100   .     S
C2438  H2444   1.101   .     S
C2445  H2497   1.099   .     S
C2445  C2450   1.400   .     S
C2445  C2446   1.401   .     S
C2446  C2447   1.385   .     S
C2446  H2459   1.099   .     S
C2447  C2448   1.428   .     S
C2447  H2457   1.100   .     S
C2448  C2451   1.382   .     S
C2448  C2449   1.428   .     S
C2449  H2458   1.100   .     S
C2449  C2450   1.385   .     S
C2450  H2460   1.099   .     S
C2451  N2452   1.351   .     S
C2451  N2456   1.351   .     S
N2452  C2453   1.351   .     S
C2453  C2464   1.383   .     S
C2453  N2454   1.350   .     S
N2454  C2455   1.350   .     S
C2455  N2456   1.350   .     S
C2461  H2498   1.099   .     S
C2461  C2462   1.400   .     S
C2461  C2466   1.401   .     S
C2462  H2469   1.100   .     S
C2462  C2463   1.385   .     S
C2463  H2467   1.099   .     S
C2463  C2464   1.428   .     S
C2464  C2465   1.429   .     S
C2465  C2466   1.385   .     S
C2465  H2468   1.099   .     S
C2466  H2470   1.099   .     S
C2471  C2476   1.400   .     S
C2471  H2499   1.099   .     S
C2471  C2472   1.400   .     S
C2472  C2473   1.385   .     S
C2472  H2479   1.099   .     S
C2473  C2474   1.429   .     S
C2473  H2477   1.100   .     S
C2474  C2475   1.429   .     S
C2474  C2485   1.381   .     S
C2475  C2476   1.384   .     S
C2475  H2478   1.100   .     S
C2476  H2480   1.100   .     S
C2481  N2486   1.350   .     S
C2481  N2482   1.350   .     S
N2482  C2483   1.351   .     S
C2483  C2490   1.385   .     S
C2483  N2484   1.349   .     S
N2484  C2485   1.352   .     S
C2485  N2486   1.352   .     S
C2487  C2488   1.434   .     S
C2487  C2492   1.431   .     S
C2488  H2495   1.101   .     S
C2488  C2489   1.366   .     S
C2489  C2490   1.426   .     S
C2489  H2493   1.100   .     S
C2490  C2491   1.428   .     S
C2491  H2494   1.100   .     S
C2491  C2492   1.368   .     S
C2492  H2496   1.101   .     S
C2500  C2505   1.434   .     S
C2500  C2501   1.434   .     S
C2500  C2508   1.440   .     S
C2501  H2514   1.101   .     S
C2501  C2502   1.368   .     S
C2502  C2503   1.428   .     S
C2502  H2506   1.099   .     S
C2503  C2530   1.386   .     S
C2503  C2504   1.427   .     S
C2504  H2507   1.100   .     S
C2504  C2505   1.367   .     S
C2505  H2515   1.101   .     S
C2508  C2509   1.434   .     S
C2508  C2513   1.434   .     S
C2509  H2516   1.102   .     S
C2509  C2510   1.366   .     S
C2510  C2511   1.429   .     S
C2510  H2517   1.100   .     S
C2511  C2556   1.385   .     S
C2511  C2512   1.427   .     S
C2512  H2518   1.100   .     S
C2512  C2513   1.368   .     S
C2513  H2519   1.101   .     S
C2520  H2572   1.099   .     S
C2520  C2525   1.401   .     S
C2520  C2521   1.401   .     S
C2521  H2534   1.100   .     S
C2521  C2522   1.384   .     S
C2522  C2523   1.429   .     S
C2522  H2532   1.099   .     S
C2523  C2524   1.428   .     S
C2523  C2526   1.383   .     S
C2524  H2533   1.100   .     S
C2524  C2525   1.385   .     S
C2525  H2535   1.100   .     S
C2526  N2527   1.352   .     S
C2526  N2531   1.351   .     S
N2527  C2528   1.351   .     S
C2528  N2529   1.352   .     S
C2528  C2539   1.382   .     S
N2529  C2530   1.350   .     S
C2530  N2531   1.350   .     S
C2536  H2573   1.099   .     S
C2536  C2537   1.400   .     S
C2536  C2541   1.400   .     S
C2537  C2538   1.385   .     S
C2537  H2544   1.100   .     S
C2538  H2542   1.099   .     S
C2538  C2539   1.429   .     S
C2539  C2540   1.428   .     S
C2540  H2543   1.099   .     S
C2540  C2541   1.385   .     S
C2541  H2545   1.100   .     S
C2546  H2574   1.099   .     S
C2546  C2551   1.400   .     S
C2546  C2547   1.400   .     S
C2547  C2548   1.385   .     S
C2547  H2554   1.100   .     S
C2548  C2549   1.429   .     S
C2548  H2552   1.099   .     S
C2549  C2550   1.429   .     S
C2549  C2560   1.383   .     S
C2550  H2553   1.099   .     S
C2550  C2551   1.385   .     S
C2551  H2555   1.100   .     S
C2556  N2557   1.352   .     S
C2556  N2561   1.352   .     S
N2557  C2558   1.352   .     S
C2558  C2565   1.385   .     S
C2558  N2559   1.352   .     S
N2559  C2560   1.350   .     S
C2560  N2561   1.350   .     S
C2562  C2563   1.435   .     S
C2562  C2567   1.434   .     S
C2563  C2564   1.368   .     S
C2563  H2570   1.101   .     S
C2564  H2568   1.100   .     S
C2564  C2565   1.429   .     S
C2565  C2566   1.427   .     S
C2566  H2569   1.100   .     S
C2566  C2567   1.367   .     S
C2567  H2571   1.100   .     S
C2575  C2583   1.440   .     S
C2575  C2576   1.434   .     S
C2575  C2580   1.435   .     S
C2576  C2577   1.368   .     S
C2576  H2589   1.101   .     S
C2577  C2578   1.427   .     S
C2577  H2581   1.101   .     S
C2578  C2579   1.428   .     S
C2578  C2605   1.384   .     S
C2579  H2582   1.099   .     S
C2579  C2580   1.368   .     S
C2580  H2590   1.101   .     S
C2583  C2584   1.434   .     S
C2583  C2588   1.434   .     S
C2584  H2591   1.101   .     S
C2584  C2585   1.367   .     S
C2585  C2586   1.428   .     S
C2585  H2592   1.100   .     S
C2586  C2587   1.428   .     S
C2586  C2631   1.385   .     S
C2587  C2588   1.367   .     S
C2587  H2593   1.100   .     S
C2588  H2594   1.100   .     S
C2595  C2596   1.400   .     S
C2595  C2600   1.400   .     S
C2595  H2647   1.099   .     S
C2596  C2597   1.384   .     S
C2596  H2609   1.100   .     S
C2597  C2598   1.429   .     S
C2597  H2607   1.099   .     S
C2598  C2601   1.383   .     S
C2598  C2599   1.429   .     S
C2599  C2600   1.385   .     S
C2599  H2608   1.099   .     S
C2600  H2610   1.100   .     S
C2601  N2602   1.351   .     S
C2601  N2606   1.352   .     S
N2602  C2603   1.351   .     S
C2603  C2614   1.382   .     S
C2603  N2604   1.352   .     S
N2604  C2605   1.350   .     S
C2605  N2606   1.350   .     S
C2611  C2616   1.401   .     S
C2611  H2648   1.099   .     S
C2611  C2612   1.401   .     S
C2612  H2619   1.100   .     S
C2612  C2613   1.385   .     S
C2613  C2614   1.429   .     S
C2613  H2617   1.099   .     S
C2614  C2615   1.429   .     S
C2615  C2616   1.384   .     S
C2615  H2618   1.100   .     S
C2616  H2620   1.099   .     S
C2621  C2626   1.400   .     S
C2621  H2649   1.100   .     S
C2621  C2622   1.400   .     S
C2622  H2629   1.099   .     S
C2622  C2623   1.386   .     S
C2623  H2627   1.099   .     S
C2623  C2624   1.428   .     S
C2624  C2625   1.428   .     S
C2624  C2635   1.382   .     S
C2625  C2626   1.385   .     S
C2625  H2628   1.099   .     S
C2626  H2630   1.100   .     S
C2631  N2636   1.350   .     S
C2631  N2632   1.352   .     S
N2632  C2633   1.351   .     S
C2633  N2634   1.351   .     S
C2633  C2640   1.385   .     S
N2634  C2635   1.351   .     S
C2635  N2636   1.351   .     S
C2637  C2642   1.435   .     S
C2637  C2638   1.432   .     S
C2638  C2639   1.368   .     S
C2638  H2645   1.101   .     S
C2639  C2640   1.427   .     S
C2639  H2643   1.100   .     S
C2640  C2641   1.427   .     S
C2641  H2644   1.100   .     S
C2641  C2642   1.368   .     S
C2642  H2646   1.100   .     S
C2650  C2651   1.433   .     S
C2650  C2655   1.435   .     S
C2650  C2658   1.443   .     S
C2651  C2652   1.369   .     S
C2651  H2664   1.101   .     S
C2652  H2656   1.100   .     S
C2652  C2653   1.428   .     S
C2653  C2654   1.427   .     S
C2653  C2680   1.386   .     S
C2654  C2655   1.368   .     S
C2654  H2657   1.100   .     S
C2655  H2665   1.101   .     S
C2658  C2663   1.435   .     S
C2658  C2659   1.433   .     S
C2659  H2666   1.101   .     S
C2659  C2660   1.368   .     S
C2660  H2667   1.099   .     S
C2660  C2661   1.428   .     S
C2661  C2706   1.387   .     S
C2661  C2662   1.427   .     S
C2662  H2668   1.100   .     S
C2662  C2663   1.369   .     S
C2663  H2669   1.101   .     S
C2670  C2675   1.400   .     S
C2670  C2671   1.400   .     S
C2670  H2722   1.099   .     S
C2671  H2684   1.099   .     S
C2671  C2672   1.385   .     S
C2672  C2673   1.429   .     S
C2672  H2682   1.099   .     S
C2673  C2674   1.429   .     S
C2673  C2676   1.382   .     S
C2674  H2683   1.100   .     S
C2674  C2675   1.385   .     S
C2675  H2685   1.100   .     S
C2676  N2677   1.351   .     S
C2676  N2681   1.352   .     S
N2677  C2678   1.351   .     S
C2678  C2689   1.383   .     S
C2678  N2679   1.354   .     S
N2679  C2680   1.351   .     S
C2680  N2681   1.352   .     S
C2686  C2687   1.400   .     S
C2686  C2691   1.400   .     S
C2686  H2723   1.100   .     S
C2687  C2688   1.385   .     S
C2687  H2694   1.100   .     S
C2688  H2692   1.099   .     S
C2688  C2689   1.429   .     S
C2689  C2690   1.429   .     S
C2690  H2693   1.099   .     S
C2690  C2691   1.384   .     S
C2691  H2695   1.100   .     S
C2696  C2697   1.401   .     S
C2696  H2724   1.099   .     S
C2696  C2701   1.400   .     S
C2697  H2704   1.100   .     S
C2697  C2698   1.385   .     S
C2698  H2702   1.099   .     S
C2698  C2699   1.428   .     S
C2699  C2700   1.429   .     S
C2699  C2710   1.383   .     S
C2700  C2701   1.385   .     S
C2700  H2703   1.099   .     S
C2701  H2705   1.100   .     S
C2706  N2711   1.351   .     S
C2706  N2707   1.351   .     S
N2707  C2708   1.352   .     S
C2708  C2715   1.384   .     S
C2708  N2709   1.350   .     S
N2709  C2710   1.350   .     S
C2710  N2711   1.351   .     S
C2712  C2717   1.431   .     S
C2712  C2713   1.431   .     S
C2713  H2720   1.100   .     S
C2713  C2714   1.368   .     S
C2714  C2715   1.425   .     S
C2714  H2718   1.100   .     S
C2715  C2716   1.427   .     S
C2716  H2719   1.100   .     S
C2716  C2717   1.367   .     S
C2717  H2721   1.101   .     S
C2725  C2730   1.433   .     S
C2725  C2733   1.445   .     S
C2725  C2726   1.432   .     S
C2726  H2739   1.101   .     S
C2726  C2727   1.367   .     S
C2727  C2728   1.427   .     S
C2727  H2731   1.100   .     S
C2728  C2755   1.385   .     S
C2728  C2729   1.426   .     S
C2729  H2732   1.100   .     S
C2729  C2730   1.368   .     S
C2730  H2740   1.100   .     S
C2733  C2738   1.433   .     S
C2733  C2734   1.432   .     S
C2734  C2735   1.368   .     S
C2734  H2741   1.101   .     S
C2735  C2736   1.427   .     S
C2735  H2742   1.100   .     S
C2736  C2781   1.385   .     S
C2736  C2737   1.427   .     S
C2737  C2738   1.366   .     S
C2737  H2743   1.100   .     S
C2738  H2744   1.101   .     S
C2745  H2797   1.099   .     S
C2745  C2746   1.400   .     S
C2745  C2750   1.401   .     S
C2746  C2747   1.385   .     S
C2746  H2759   1.099   .     S
C2747  H2757   1.099   .     S
C2747  C2748   1.429   .     S
C2748  C2749   1.429   .     S
C2748  C2751   1.382   .     S
C2749  C2750   1.385   .     S
C2749  H2758   1.099   .     S
C2750  H2760   1.099   .     S
C2751  N2752   1.351   .     S
C2751  N2756   1.351   .     S
N2752  C2753   1.352   .     S
C2753  N2754   1.351   .     S
C2753  C2764   1.383   .     S
N2754  C2755   1.350   .     S
C2755  N2756   1.350   .     S
C2761  H2798   1.099   .     S
C2761  C2762   1.400   .     S
C2761  C2766   1.401   .     S
C2762  H2769   1.099   .     S
C2762  C2763   1.384   .     S
C2763  C2764   1.429   .     S
C2763  H2767   1.100   .     S
C2764  C2765   1.428   .     S
C2765  C2766   1.385   .     S
C2765  H2768   1.100   .     S
C2766  H2770   1.100   .     S
C2771  C2776   1.400   .     S
C2771  C2772   1.401   .     S
C2771  H2799   1.099   .     S
C2772  C2773   1.385   .     S
C2772  H2779   1.099   .     S
C2773  H2777   1.100   .     S
C2773  C2774   1.429   .     S
C2774  C2775   1.428   .     S
C2774  C2785   1.382   .     S
C2775  H2778   1.099   .     S
C2775  C2776   1.385   .     S
C2776  H2780   1.100   .     S
C2781  N2782   1.351   .     S
C2781  N2786   1.351   .     S
N2782  C2783   1.350   .     S
C2783  C2790   1.384   .     S
C2783  N2784   1.349   .     S
N2784  C2785   1.352   .     S
C2785  N2786   1.351   .     S
C2787  C2788   1.431   .     S
C2787  C2792   1.432   .     S
C2788  C2789   1.367   .     S
C2788  H2795   1.100   .     S
C2789  C2790   1.426   .     S
C2789  H2793   1.101   .     S
C2790  C2791   1.427   .     S
C2791  C2792   1.369   .     S
C2791  H2794   1.100   .     S
C2792  H2796   1.100   .     S
C2800  C2808   1.441   .     S
C2800  C2805   1.434   .     S
C2800  C2801   1.434   .     S
C2801  H2814   1.101   .     S
C2801  C2802   1.368   .     S
C2802  H2806   1.099   .     S
C2802  C2803   1.427   .     S
C2803  C2804   1.428   .     S
C2803  C2830   1.385   .     S
C2804  C2805   1.367   .     S
C2804  H2807   1.100   .     S
C2805  H2815   1.101   .     S
C2808  C2813   1.435   .     S
C2808  C2809   1.434   .     S
C2809  H2816   1.102   .     S
C2809  C2810   1.368   .     S
C2810  H2817   1.100   .     S
C2810  C2811   1.429   .     S
C2811  C2812   1.427   .     S
C2811  C2856   1.385   .     S
C2812  C2813   1.368   .     S
C2812  H2818   1.100   .     S
C2813  H2819   1.101   .     S
C2820  H2872   1.100   .     S
C2820  C2821   1.400   .     S
C2820  C2825   1.401   .     S
C2821  H2834   1.100   .     S
C2821  C2822   1.384   .     S
C2822  H2832   1.100   .     S
C2822  C2823   1.428   .     S
C2823  C2826   1.382   .     S
C2823  C2824   1.429   .     S
C2824  H2833   1.100   .     S
C2824  C2825   1.384   .     S
C2825  H2835   1.100   .     S
C2826  N2831   1.352   .     S
C2826  N2827   1.351   .     S
N2827  C2828   1.352   .     S
C2828  N2829   1.352   .     S
C2828  C2839   1.382   .     S
N2829  C2830   1.351   .     S
C2830  N2831   1.350   .     S
C2836  C2841   1.399   .     S
C2836  C2837   1.401   .     S
C2836  H2873   1.100   .     S
C2837  C2838   1.385   .     S
C2837  H2844   1.100   .     S
C2838  C2839   1.429   .     S
C2838  H2842   1.099   .     S
C2839  C2840   1.429   .     S
C2840  H2843   1.099   .     S
C2840  C2841   1.385   .     S
C2841  H2845   1.100   .     S
C2846  C2847   1.401   .     S
C2846  C2851   1.400   .     S
C2846  H2874   1.100   .     S
C2847  H2854   1.100   .     S
C2847  C2848   1.384   .     S
C2848  H2852   1.100   .     S
C2848  C2849   1.428   .     S
C2849  C2850   1.428   .     S
C2849  C2860   1.383   .     S
C2850  H2853   1.100   .     S
C2850  C2851   1.385   .     S
C2851  H2855   1.100   .     S
C2856  N2857   1.351   .     S
C2856  N2861   1.351   .     S
N2857  C2858   1.352   .     S
C2858  N2859   1.350   .     S
C2858  C2865   1.385   .     S
N2859  C2860   1.352   .     S
C2860  N2861   1.353   .     S
C2862  C2863   1.434   .     S
C2862  C2867   1.433   .     S
C2863  H2870   1.101   .     S
C2863  C2864   1.367   .     S
C2864  H2868   1.101   .     S
C2864  C2865   1.427   .     S
C2865  C2866   1.428   .     S
C2866  C2867   1.368   .     S
C2866  H2869   1.100   .     S
C2867  H2871   1.101   .     S
C2875  C2876   1.435   .     S
C2875  C2883   1.436   .     S
C2875  C2880   1.436   .     S
C2876  C2877   1.368   .     S
C2876  H2889   1.101   .     S
C2877  C2878   1.427   .     S
C2877  H2881   1.100   .     S
C2878  C2879   1.429   .     S
C2878  C2905   1.386   .     S
C2879  H2882   1.100   .     S
C2879  C2880   1.367   .     S
C2880  H2890   1.101   .     S
C2883  C2888   1.434   .     S
C2883  C2884   1.435   .     S
C2884  C2885   1.368   .     S
C2884  H2891   1.101   .     S
C2885  C2886   1.427   .     S
C2885  H2892   1.100   .     S
C2886  C2931   1.386   .     S
C2886  C2887   1.427   .     S
C2887  H2893   1.100   .     S
C2887  C2888   1.366   .     S
C2888  H2894   1.100   .     S
C2895  C2900   1.400   .     S
C2895  C2896   1.401   .     S
C2895  H2947   1.099   .     S
C2896  H2909   1.100   .     S
C2896  C2897   1.384   .     S
C2897  H2907   1.099   .     S
C2897  C2898   1.429   .     S
C2898  C2899   1.429   .     S
C2898  C2901   1.383   .     S
C2899  H2908   1.099   .     S
C2899  C2900   1.385   .     S
C2900  H2910   1.099   .     S
C2901  N2902   1.352   .     S
C2901  N2906   1.352   .     S
N2902  C2903   1.351   .     S
C2903  N2904   1.352   .     S
C2903  C2914   1.383   .     S
N2904  C2905   1.351   .     S
C2905  N2906   1.350   .     S
C2911  C2916   1.400   .     S
C2911  H2948   1.099   .     S
C2911  C2912   1.401   .     S
C2912  C2913   1.385   .     S
C2912  H2919   1.099   .     S
C2913  H2917   1.099   .     S
C2913  C2914   1.428   .     S
C2914  C2915   1.429   .     S
C2915  H2918   1.099   .     S
C2915  C2916   1.385   .     S
C2916  H2920   1.100   .     S
C2921  C2926   1.399   .     S
C2921  H2949   1.099   .     S
C2921  C2922   1.400   .     S
C2922  H2929   1.100   .     S
C2922  C2923   1.385   .     S
C2923  C2924   1.429   .     S
C2923  H2927   1.100   .     S
C2924  C2935   1.382   .     S
C2924  C2925   1.429   .     S
C2925  H2928   1.099   .     S
C2925  C2926   1.385   .     S
C2926  H2930   1.100   .     S
C2931  N2932   1.350   .     S
C2931  N2936   1.350   .     S
N2932  C2933   1.351   .     S
C2933  C2940   1.385   .     S
C2933  N2934   1.351   .     S
N2934  C2935   1.352   .     S
C2935  N2936   1.353   .     S
C2937  C2942   1.434   .     S
C2937  C2938   1.433   .     S
C2938  C2939   1.367   .     S
C2938  H2945   1.101   .     S
C2939  H2943   1.100   .     S
C2939  C2940   1.427   .     S
C2940  C2941   1.427   .     S
C2941  H2944   1.100   .     S
C2941  C2942   1.369   .     S
C2942  H2946   1.101   .     S
C2950  C2951   1.436   .     S
C2950  C2955   1.433   .     S
C2950  C2958   1.437   .     S
C2951  H2964   1.100   .     S
C2951  C2952   1.368   .     S
C2952  H2956   1.100   .     S
C2952  C2953   1.427   .     S
C2953  C2980   1.385   .     S
C2953  C2954   1.427   .     S
C2954  C2955   1.367   .     S
C2954  H2957   1.100   .     S
C2955  H2965   1.101   .     S
C2958  C2963   1.434   .     S
C2958  C2959   1.436   .     S
C2959  H2966   1.100   .     S
C2959  C2960   1.367   .     S
C2960  H2967   1.099   .     S
C2960  C2961   1.427   .     S
C2961  C2962   1.429   .     S
C2961  C3006   1.384   .     S
C2962  H2968   1.100   .     S
C2962  C2963   1.368   .     S
C2963  H2969   1.100   .     S
C2970  C2975   1.401   .     S
C2970  H3022   1.099   .     S
C2970  C2971   1.400   .     S
C2971  C2972   1.385   .     S
C2971  H2984   1.099   .     S
C2972  C2973   1.428   .     S
C2972  H2982   1.100   .     S
C2973  C2976   1.382   .     S
C2973  C2974   1.429   .     S
C2974  C2975   1.385   .     S
C2974  H2983   1.099   .     S
C2975  H2985   1.099   .     S
C2976  N2977   1.351   .     S
C2976  N2981   1.351   .     S
N2977  C2978   1.351   .     S
C2978  N2979   1.351   .     S
C2978  C2989   1.382   .     S
N2979  C2980   1.350   .     S
C2980  N2981   1.350   .     S
C2986  H3023   1.099   .     S
C2986  C2987   1.401   .     S
C2986  C2991   1.400   .     S
C2987  H2994   1.100   .     S
C2987  C2988   1.384   .     S
C2988  C2989   1.428   .     S
C2988  H2992   1.100   .     S
C2989  C2990   1.429   .     S
C2990  C2991   1.385   .     S
C2990  H2993   1.100   .     S
C2991  H2995   1.099   .     S
C2996  H3024   1.099   .     S
C2996  C3001   1.401   .     S
C2996  C2997   1.400   .     S
C2997  H3004   1.100   .     S
C2997  C2998   1.384   .     S
C2998  H3002   1.099   .     S
C2998  C2999   1.428   .     S
C2999  C3010   1.383   .     S
C2999  C3000   1.429   .     S
C3000  C3001   1.384   .     S
C3000  H3003   1.099   .     S
C3001  H3005   1.100   .     S
C3006  N3007   1.350   .     S
C3006  N3011   1.351   .     S
N3007  C3008   1.351   .     S
C3008  N3009   1.350   .     S
C3008  C3015   1.384   .     S
N3009  C3010   1.352   .     S
C3010  N3011   1.352   .     S
C3012  C3017   1.435   .     S
C3012  C3013   1.437   .     S
C3013  H3020   1.100   .     S
C3013  C3014   1.366   .     S
C3014  C3015   1.428   .     S
C3014  H3018   1.100   .     S
C3015  C3016   1.428   .     S
C3016  H3019   1.100   .     S
C3016  C3017   1.369   .     S
C3017  H3021   1.101   .     S
C3025  C3033   1.439   .     S
C3025  C3030   1.434   .     S
C3025  C3026   1.435   .     S
C3026  C3027   1.368   .     S
C3026  H3039   1.101   .     S
C3027  H3031   1.100   .     S
C3027  C3028   1.427   .     S
C3028  C3055   1.385   .     S
C3028  C3029   1.428   .     S
C3029  C3030   1.367   .     S
C3029  H3032   1.100   .     S
C3030  H3040   1.101   .     S
C3033  C3034   1.434   .     S
C3033  C3038   1.435   .     S
C3034  C3035   1.368   .     S
C3034  H3041   1.101   .     S
C3035  H3042   1.100   .     S
C3035  C3036   1.428   .     S
C3036  C3037   1.427   .     S
C3036  C3081   1.385   .     S
C3037  C3038   1.367   .     S
C3037  H3043   1.100   .     S
C3038  H3044   1.101   .     S
C3045  H3097   1.099   .     S
C3045  C3046   1.400   .     S
C3045  C3050   1.401   .     S
C3046  C3047   1.385   .     S
C3046  H3059   1.100   .     S
C3047  H3057   1.100   .     S
C3047  C3048   1.428   .     S
C3048  C3049   1.429   .     S
C3048  C3051   1.383   .     S
C3049  H3058   1.099   .     S
C3049  C3050   1.384   .     S
C3050  H3060   1.100   .     S
C3051  N3052   1.351   .     S
C3051  N3056   1.351   .     S
N3052  C3053   1.351   .     S
C3053  C3064   1.382   .     S
C3053  N3054   1.352   .     S
N3054  C3055   1.351   .     S
C3055  N3056   1.350   .     S
C3061  H3098   1.099   .     S
C3061  C3066   1.400   .     S
C3061  C3062   1.400   .     S
C3062  H3069   1.100   .     S
C3062  C3063   1.384   .     S
C3063  C3064   1.429   .     S
C3063  H3067   1.100   .     S
C3064  C3065   1.428   .     S
C3065  C3066   1.385   .     S
C3065  H3068   1.100   .     S
C3066  H3070   1.099   .     S
C3071  C3076   1.400   .     S
C3071  H3099   1.099   .     S
C3071  C3072   1.401   .     S
C3072  C3073   1.385   .     S
C3072  H3079   1.100   .     S
C3073  C3074   1.428   .     S
C3073  H3077   1.099   .     S
C3074  C3085   1.382   .     S
C3074  C3075   1.428   .     S
C3075  H3078   1.100   .     S
C3075  C3076   1.384   .     S
C3076  H3080   1.100   .     S
C3081  N3086   1.350   .     S
C3081  N3082   1.352   .     S
N3082  C3083   1.351   .     S
C3083  C3090   1.385   .     S
C3083  N3084   1.352   .     S
N3084  C3085   1.351   .     S
C3085  N3086   1.351   .     S
C3087  C3092   1.432   .     S
C3087  C3088   1.434   .     S
C3088  C3089   1.369   .     S
C3088  H3095   1.100   .     S
C3089  H3093   1.099   .     S
C3089  C3090   1.427   .     S
C3090  C3091   1.428   .     S
C3091  H3094   1.100   .     S
C3091  C3092   1.367   .     S
C3092  H3096   1.100   .     S
C3100  C3101   1.434   .     S
C3100  C3105   1.434   .     S
C3100  C3108   1.441   .     S
C3101  H3114   1.101   .     S
C3101  C3102   1.366   .     S
C3102  C3103   1.427   .     S
C3102  H3106   1.101   .     S
C3103  C3130   1.385   .     S
C3103  C3104   1.429   .     S
C3104  C3105   1.370   .     S
C3104  H3107   1.100   .     S
C3105  H3115   1.100   .     S
C3108  C3113   1.433   .     S
C3108  C3109   1.436   .     S
C3109  H3116   1.101   .     S
C3109  C3110   1.370   .     S
C3110  C3111   1.427   .     S
C3110  H3117   1.100   .     S
C3111  C3112   1.426   .     S
C3111  C3156   1.385   .     S
C3112  H3118   1.100   .     S
C3112  C3113   1.366   .     S
C3113  H3119   1.101   .     S
C3120  C3121   1.400   .     S
C3120  H3172   1.100   .     S
C3120  C3125   1.401   .     S
C3121  H3134   1.100   .     S
C3121  C3122   1.384   .     S
C3122  C3123   1.429   .     S
C3122  H3132   1.099   .     S
C3123  C3126   1.382   .     S
C3123  C3124   1.430   .     S
C3124  C3125   1.384   .     S
C3124  H3133   1.099   .     S
C3125  H3135   1.100   .     S
C3126  N3131   1.353   .     S
C3126  N3127   1.351   .     S
N3127  C3128   1.351   .     S
C3128  N3129   1.351   .     S
C3128  C3139   1.383   .     S
N3129  C3130   1.352   .     S
C3130  N3131   1.349   .     S
C3136  C3137   1.400   .     S
C3136  H3173   1.100   .     S
C3136  C3141   1.400   .     S
C3137  H3144   1.100   .     S
C3137  C3138   1.384   .     S
C3138  C3139   1.429   .     S
C3138  H3142   1.099   .     S
C3139  C3140   1.428   .     S
C3140  C3141   1.385   .     S
C3140  H3143   1.099   .     S
C3141  H3145   1.099   .     S
C3146  H3174   1.099   .     S
C3146  C3147   1.401   .     S
C3146  C3151   1.400   .     S
C3147  C3148   1.384   .     S
C3147  H3154   1.099   .     S
C3148  H3152   1.099   .     S
C3148  C3149   1.429   .     S
C3149  C3150   1.430   .     S
C3149  C3160   1.381   .     S
C3150  H3153   1.099   .     S
C3150  C3151   1.385   .     S
C3151  H3155   1.099   .     S
C3156  N3161   1.349   .     S
C3156  N3157   1.349   .     S
N3157  C3158   1.351   .     S
C3158  C3165   1.385   .     S
C3158  N3159   1.349   .     S
N3159  C3160   1.356   .     S
C3160  N3161   1.354   .     S
C3162  C3163   1.432   .     S
C3162  C3167   1.436   .     S
C3163  H3170   1.101   .     S
C3163  C3164   1.364   .     S
C3164  H3168   1.099   .     S
C3164  C3165   1.427   .     S
C3165  C3166   1.429   .     S
C3166  H3169   1.100   .     S
C3166  C3167   1.372   .     S
C3167  H3171   1.100   .     S
C3175  C3183   1.439   .     S
C3175  C3180   1.435   .     S
C3175  C3176   1.434   .     S
C3176  H3189   1.101   .     S
C3176  C3177   1.368   .     S
C3177  C3178   1.427   .     S
C3177  H3181   1.100   .     S
C3178  C3205   1.385   .     S
C3178  C3179   1.429   .     S
C3179  H3182   1.100   .     S
C3179  C3180   1.367   .     S
C3180  H3190   1.101   .     S
C3183  C3184   1.435   .     S
C3183  C3188   1.434   .     S
C3184  C3185   1.368   .     S
C3184  H3191   1.101   .     S
C3185  C3186   1.428   .     S
C3185  H3192   1.100   .     S
C3186  C3231   1.386   .     S
C3186  C3187   1.428   .     S
C3187  C3188   1.368   .     S
C3187  H3193   1.099   .     S
C3188  H3194   1.100   .     S
C3195  C3200   1.401   .     S
C3195  C3196   1.400   .     S
C3195  H3247   1.099   .     S
C3196  C3197   1.384   .     S
C3196  H3209   1.100   .     S
C3197  H3207   1.099   .     S
C3197  C3198   1.429   .     S
C3198  C3199   1.429   .     S
C3198  C3201   1.383   .     S
C3199  H3208   1.100   .     S
C3199  C3200   1.385   .     S
C3200  H3210   1.098   .     S
C3201  N3202   1.352   .     S
C3201  N3206   1.352   .     S
N3202  C3203   1.352   .     S
C3203  N3204   1.352   .     S
C3203  C3214   1.383   .     S
N3204  C3205   1.350   .     S
C3205  N3206   1.350   .     S
C3211  H3248   1.100   .     S
C3211  C3216   1.400   .     S
C3211  C3212   1.401   .     S
C3212  H3219   1.098   .     S
C3212  C3213   1.384   .     S
C3213  H3217   1.099   .     S
C3213  C3214   1.428   .     S
C3214  C3215   1.430   .     S
C3215  H3218   1.099   .     S
C3215  C3216   1.384   .     S
C3216  H3220   1.099   .     S
C3221  C3222   1.401   .     S
C3221  H3249   1.099   .     S
C3221  C3226   1.400   .     S
C3222  H3229   1.100   .     S
C3222  C3223   1.384   .     S
C3223  H3227   1.099   .     S
C3223  C3224   1.429   .     S
C3224  C3235   1.383   .     S
C3224  C3225   1.429   .     S
C3225  H3228   1.099   .     S
C3225  C3226   1.385   .     S
C3226  H3230   1.100   .     S
C3231  N3232   1.350   .     S
C3231  N3236   1.350   .     S
N3232  C3233   1.351   .     S
C3233  N3234   1.350   .     S
C3233  C3240   1.385   .     S
N3234  C3235   1.352   .     S
C3235  N3236   1.352   .     S
C3237  C3238   1.435   .     S
C3237  C3242   1.437   .     S
C3238  C3239   1.367   .     S
C3238  H3245   1.100   .     S
C3239  C3240   1.428   .     S
C3239  H3243   1.100   .     S
C3240  C3241   1.429   .     S
C3241  H3244   1.100   .     S
C3241  C3242   1.368   .     S
C3242  H3246   1.101   .     S
C3250  C3255   1.435   .     S
C3250  C3251   1.435   .     S
C3250  C3258   1.438   .     S
C3251  C3252   1.368   .     S
C3251  H3264   1.101   .     S
C3252  H3256   1.100   .     S
C3252  C3253   1.428   .     S
C3253  C3254   1.427   .     S
C3253  C3280   1.385   .     S
C3254  H3257   1.100   .     S
C3254  C3255   1.367   .     S
C3255  H3265   1.101   .     S
C3258  C3263   1.435   .     S
C3258  C3259   1.434   .     S
C3259  H3266   1.101   .     S
C3259  C3260   1.366   .     S
C3260  C3261   1.428   .     S
C3260  H3267   1.100   .     S
C3261  C3262   1.428   .     S
C3261  C3306   1.385   .     S
C3262  H3268   1.100   .     S
C3262  C3263   1.369   .     S
C3263  H3269   1.101   .     S
C3270  C3275   1.401   .     S
C3270  H3322   1.099   .     S
C3270  C3271   1.400   .     S
C3271  H3284   1.100   .     S
C3271  C3272   1.385   .     S
C3272  C3273   1.429   .     S
C3272  H3282   1.099   .     S
C3273  C3274   1.428   .     S
C3273  C3276   1.383   .     S
C3274  H3283   1.100   .     S
C3274  C3275   1.384   .     S
C3275  H3285   1.100   .     S
C3276  N3281   1.351   .     S
C3276  N3277   1.350   .     S
N3277  C3278   1.351   .     S
C3278  C3289   1.383   .     S
C3278  N3279   1.353   .     S
N3279  C3280   1.350   .     S
C3280  N3281   1.350   .     S
C3286  C3287   1.401   .     S
C3286  H3323   1.099   .     S
C3286  C3291   1.400   .     S
C3287  C3288   1.385   .     S
C3287  H3294   1.100   .     S
C3288  C3289   1.429   .     S
C3288  H3292   1.099   .     S
C3289  C3290   1.428   .     S
C3290  H3293   1.099   .     S
C3290  C3291   1.385   .     S
C3291  H3295   1.099   .     S
C3296  C3297   1.400   .     S
C3296  C3301   1.400   .     S
C3296  H3324   1.099   .     S
C3297  C3298   1.385   .     S
C3297  H3304   1.100   .     S
C3298  H3302   1.098   .     S
C3298  C3299   1.428   .     S
C3299  C3310   1.382   .     S
C3299  C3300   1.429   .     S
C3300  H3303   1.099   .     S
C3300  C3301   1.386   .     S
C3301  H3305   1.100   .     S
C3306  N3307   1.352   .     S
C3306  N3311   1.351   .     S
N3307  C3308   1.352   .     S
C3308  C3315   1.387   .     S
C3308  N3309   1.350   .     S
N3309  C3310   1.351   .     S
C3310  N3311   1.350   .     S
C3312  C3313   1.434   .     S
C3312  C3317   1.429   .     S
C3313  H3320   1.101   .     S
C3313  C3314   1.370   .     S
C3314  H3318   1.100   .     S
C3314  C3315   1.427   .     S
C3315  C3316   1.426   .     S
C3316  C3317   1.368   .     S
C3316  H3319   1.100   .     S
C3317  H3321   1.101   .     S
C3325  C3333   1.439   .     S
C3325  C3326   1.434   .     S
C3325  C3330   1.435   .     S
C3326  C3327   1.368   .     S
C3326  H3339   1.101   .     S
C3327  H3331   1.100   .     S
C3327  C3328   1.427   .     S
C3328  C3355   1.385   .     S
C3328  C3329   1.427   .     S
C3329  H3332   1.101   .     S
C3329  C3330   1.367   .     S
C3330  H3340   1.101   .     S
C3333  C3338   1.435   .     S
C3333  C3334   1.434   .     S
C3334  C3335   1.367   .     S
C3334  H3341   1.101   .     S
C3335  C3336   1.428   .     S
C3335  H3342   1.100   .     S
C3336  C3381   1.385   .     S
C3336  C3337   1.428   .     S
C3337  C3338   1.368   .     S
C3337  H3343   1.100   .     S
C3338  H3344   1.101   .     S
C3345  H3397   1.099   .     S
C3345  C3350   1.401   .     S
C3345  C3346   1.401   .     S
C3346  H3359   1.099   .     S
C3346  C3347   1.384   .     S
C3347  C3348   1.429   .     S
C3347  H3357   1.099   .     S
C3348  C3351   1.383   .     S
C3348  C3349   1.429   .     S
C3349  C3350   1.384   .     S
C3349  H3358   1.099   .     S
C3350  H3360   1.100   .     S
C3351  N3356   1.350   .     S
C3351  N3352   1.350   .     S
N3352  C3353   1.351   .     S
C3353  C3364   1.382   .     S
C3353  N3354   1.352   .     S
N3354  C3355   1.351   .     S
C3355  N3356   1.352   .     S
C3361  C3366   1.401   .     S
C3361  H3398   1.099   .     S
C3361  C3362   1.400   .     S
C3362  C3363   1.384   .     S
C3362  H3369   1.099   .     S
C3363  H3367   1.099   .     S
C3363  C3364   1.430   .     S
C3364  C3365   1.428   .     S
C3365  C3366   1.384   .     S
C3365  H3368   1.099   .     S
C3366  H3370   1.100   .     S
C3371  H3399   1.100   .     S
C3371  C3372   1.400   .     S
C3371  C3376   1.400   .     S
C3372  C3373   1.385   .     S
C3372  H3379   1.101   .     S
C3373  H3377   1.100   .     S
C3373  C3374   1.428   .     S
C3374  C3385   1.382   .     S
C3374  C3375   1.429   .     S
C3375  C3376   1.385   .     S
C3375  H3378   1.100   .     S
C3376  H3380   1.099   .     S
C3381  N3386   1.351   .     S
C3381  N3382   1.350   .     S
N3382  C3383   1.352   .     S
C3383  N3384   1.350   .     S
C3383  C3390   1.385   .     S
N3384  C3385   1.352   .     S
C3385  N3386   1.352   .     S
C3387  C3392   1.436   .     S
C3387  C3388   1.436   .     S
C3388  H3395   1.100   .     S
C3388  C3389   1.366   .     S
C3389  C3390   1.428   .     S
C3389  H3393   1.101   .     S
C3390  C3391   1.428   .     S
C3391  H3394   1.100   .     S
C3391  C3392   1.369   .     S
C3392  H3396   1.101   .     S
C3400  C3401   1.434   .     S
C3400  C3408   1.439   .     S
C3400  C3405   1.435   .     S
C3401  C3402   1.367   .     S
C3401  H3414   1.101   .     S
C3402  H3406   1.100   .     S
C3402  C3403   1.428   .     S
C3403  C3430   1.385   .     S
C3403  C3404   1.427   .     S
C3404  H3407   1.101   .     S
C3404  C3405   1.368   .     S
C3405  H3415   1.100   .     S
C3408  C3413   1.434   .     S
C3408  C3409   1.434   .     S
C3409  H3416   1.101   .     S
C3409  C3410   1.369   .     S
C3410  H3417   1.100   .     S
C3410  C3411   1.428   .     S
C3411  C3456   1.384   .     S
C3411  C3412   1.428   .     S
C3412  H3418   1.099   .     S
C3412  C3413   1.368   .     S
C3413  H3419   1.101   .     S
C3420  C3425   1.400   .     S
C3420  C3421   1.401   .     S
C3420  H3472   1.099   .     S
C3421  C3422   1.384   .     S
C3421  H3434   1.100   .     S
C3422  H3432   1.100   .     S
C3422  C3423   1.429   .     S
C3423  C3424   1.429   .     S
C3423  C3426   1.382   .     S
C3424  H3433   1.099   .     S
C3424  C3425   1.384   .     S
C3425  H3435   1.101   .     S
C3426  N3431   1.352   .     S
C3426  N3427   1.350   .     S
N3427  C3428   1.351   .     S
C3428  C3439   1.383   .     S
C3428  N3429   1.351   .     S
N3429  C3430   1.350   .     S
C3430  N3431   1.350   .     S
C3436  C3437   1.401   .     S
C3436  H3473   1.100   .     S
C3436  C3441   1.399   .     S
C3437  H3444   1.100   .     S
C3437  C3438   1.385   .     S
C3438  C3439   1.429   .     S
C3438  H3442   1.099   .     S
C3439  C3440   1.428   .     S
C3440  C3441   1.385   .     S
C3440  H3443   1.099   .     S
C3441  H3445   1.099   .     S
C3446  C3447   1.401   .     S
C3446  C3451   1.400   .     S
C3446  H3474   1.099   .     S
C3447  H3454   1.100   .     S
C3447  C3448   1.384   .     S
C3448  H3452   1.100   .     S
C3448  C3449   1.429   .     S
C3449  C3460   1.383   .     S
C3449  C3450   1.429   .     S
C3450  C3451   1.385   .     S
C3450  H3453   1.099   .     S
C3451  H3455   1.100   .     S
C3456  N3457   1.351   .     S
C3456  N3461   1.350   .     S
N3457  C3458   1.351   .     S
C3458  C3465   1.386   .     S
C3458  N3459   1.351   .     S
N3459  C3460   1.352   .     S
C3460  N3461   1.352   .     S
C3462  C3467   1.434   .     S
C3462  C3463   1.434   .     S
C3463  C3464   1.367   .     S
C3463  H3470   1.100   .     S
C3464  H3468   1.100   .     S
C3464  C3465   1.427   .     S
C3465  C3466   1.428   .     S
C3466  H3469   1.100   .     S
C3466  C3467   1.368   .     S
C3467  H3471   1.101   .     S
C3475  C3483   1.439   .     S
C3475  C3480   1.435   .     S
C3475  C3476   1.434   .     S
C3476  H3489   1.100   .     S
C3476  C3477   1.367   .     S
C3477  C3478   1.428   .     S
C3477  H3481   1.100   .     S
C3478  C3505   1.385   .     S
C3478  C3479   1.428   .     S
C3479  C3480   1.367   .     S
C3479  H3482   1.100   .     S
C3480  H3490   1.100   .     S
C3483  C3484   1.435   .     S
C3483  C3488   1.435   .     S
C3484  C3485   1.368   .     S
C3484  H3491   1.100   .     S
C3485  H3492   1.099   .     S
C3485  C3486   1.428   .     S
C3486  C3487   1.427   .     S
C3486  C3531   1.384   .     S
C3487  H3493   1.100   .     S
C3487  C3488   1.368   .     S
C3488  H3494   1.100   .     S
C3495  C3496   1.400   .     S
C3495  H3547   1.099   .     S
C3495  C3500   1.401   .     S
C3496  H3509   1.100   .     S
C3496  C3497   1.385   .     S
C3497  C3498   1.428   .     S
C3497  H3507   1.099   .     S
C3498  C3501   1.382   .     S
C3498  C3499   1.430   .     S
C3499  H3508   1.100   .     S
C3499  C3500   1.384   .     S
C3500  H3510   1.100   .     S
C3501  N3506   1.351   .     S
C3501  N3502   1.351   .     S
N3502  C3503   1.350   .     S
C3503  N3504   1.350   .     S
C3503  C3514   1.382   .     S
N3504  C3505   1.351   .     S
C3505  N3506   1.350   .     S
C3511  C3516   1.400   .     S
C3511  C3512   1.401   .     S
C3511  H3548   1.100   .     S
C3512  H3519   1.100   .     S
C3512  C3513   1.385   .     S
C3513  H3517   1.099   .     S
C3513  C3514   1.429   .     S
C3514  C3515   1.429   .     S
C3515  H3518   1.100   .     S
C3515  C3516   1.385   .     S
C3516  H3520   1.099   .     S
C3521  C3526   1.401   .     S
C3521  H3549   1.099   .     S
C3521  C3522   1.401   .     S
C3522  C3523   1.385   .     S
C3522  H3529   1.099   .     S
C3523  C3524   1.429   .     S
C3523  H3527   1.098   .     S
C3524  C3535   1.383   .     S
C3524  C3525   1.429   .     S
C3525  H3528   1.099   .     S
C3525  C3526   1.384   .     S
C3526  H3530   1.099   .     S
C3531  N3536   1.350   .     S
C3531  N3532   1.352   .     S
N3532  C3533   1.352   .     S
C3533  N3534   1.352   .     S
C3533  C3540   1.386   .     S
N3534  C3535   1.352   .     S
C3535  N3536   1.351   .     S
C3537  C3538   1.432   .     S
C3537  C3542   1.436   .     S
C3538  C3539   1.369   .     S
C3538  H3545   1.101   .     S
C3539  H3543   1.100   .     S
C3539  C3540   1.428   .     S
C3540  C3541   1.427   .     S
C3541  C3542   1.368   .     S
C3541  H3544   1.100   .     S
C3542  H3546   1.101   .     S
C3550  C3551   1.435   .     S
C3550  C3558   1.435   .     S
C3550  C3555   1.436   .     S
C3551  C3552   1.367   .     S
C3551  H3564   1.101   .     S
C3552  C3553   1.429   .     S
C3552  H3556   1.099   .     S
C3553  C3580   1.385   .     S
C3553  C3554   1.428   .     S
C3554  C3555   1.368   .     S
C3554  H3557   1.099   .     S
C3555  H3565   1.100   .     S
C3558  C3563   1.436   .     S
C3558  C3559   1.436   .     S
C3559  H3566   1.101   .     S
C3559  C3560   1.367   .     S
C3560  C3561   1.428   .     S
C3560  H3567   1.100   .     S
C3561  C3606   1.385   .     S
C3561  C3562   1.427   .     S
C3562  C3563   1.368   .     S
C3562  H3568   1.100   .     S
C3563  H3569   1.101   .     S
C3570  H3622   1.099   .     S
C3570  C3571   1.400   .     S
C3570  C3575   1.401   .     S
C3571  H3584   1.099   .     S
C3571  C3572   1.384   .     S
C3572  C3573   1.428   .     S
C3572  H3582   1.099   .     S
C3573  C3574   1.429   .     S
C3573  C3576   1.383   .     S
C3574  C3575   1.385   .     S
C3574  H3583   1.099   .     S
C3575  H3585   1.099   .     S
C3576  N3581   1.351   .     S
C3576  N3577   1.351   .     S
N3577  C3578   1.351   .     S
C3578  N3579   1.352   .     S
C3578  C3589   1.382   .     S
N3579  C3580   1.351   .     S
C3580  N3581   1.351   .     S
C3586  C3591   1.400   .     S
C3586  C3587   1.401   .     S
C3586  H3623   1.099   .     S
C3587  H3594   1.100   .     S
C3587  C3588   1.385   .     S
C3588  H3592   1.099   .     S
C3588  C3589   1.430   .     S
C3589  C3590   1.429   .     S
C3590  C3591   1.384   .     S
C3590  H3593   1.100   .     S
C3591  H3595   1.100   .     S
C3596  C3597   1.400   .     S
C3596  C3601   1.400   .     S
C3596  H3624   1.100   .     S
C3597  C3598   1.385   .     S
C3597  H3604   1.100   .     S
C3598  C3599   1.429   .     S
C3598  H3602   1.099   .     S
C3599  C3600   1.429   .     S
C3599  C3610   1.382   .     S
C3600  H3603   1.099   .     S
C3600  C3601   1.385   .     S
C3601  H3605   1.099   .     S
C3606  N3611   1.351   .     S
C3606  N3607   1.352   .     S
N3607  C3608   1.351   .     S
C3608  C3615   1.385   .     S
C3608  N3609   1.350   .     S
N3609  C3610   1.352   .     S
C3610  N3611   1.351   .     S
C3612  C3613   1.435   .     S
C3612  C3617   1.432   .     S
C3613  H3620   1.100   .     S
C3613  C3614   1.368   .     S
C3614  H3618   1.100   .     S
C3614  C3615   1.427   .     S
C3615  C3616   1.428   .     S
C3616  H3619   1.100   .     S
C3616  C3617   1.368   .     S
C3617  H3621   1.102   .     S
C3625  C3630   1.435   .     S
C3625  C3626   1.435   .     S
C3625  C3633   1.439   .     S
C3626  C3627   1.368   .     S
C3626  H3639   1.100   .     S
C3627  C3628   1.428   .     S
C3627  H3631   1.100   .     S
C3628  C3655   1.385   .     S
C3628  C3629   1.428   .     S
C3629  H3632   1.100   .     S
C3629  C3630   1.368   .     S
C3630  H3640   1.101   .     S
C3633  C3634   1.434   .     S
C3633  C3638   1.435   .     S
C3634  H3641   1.101   .     S
C3634  C3635   1.368   .     S
C3635  H3642   1.100   .     S
C3635  C3636   1.427   .     S
C3636  C3637   1.428   .     S
C3636  C3681   1.386   .     S
C3637  H3643   1.100   .     S
C3637  C3638   1.368   .     S
C3638  H3644   1.100   .     S
C3645  H3697   1.099   .     S
C3645  C3650   1.401   .     S
C3645  C3646   1.401   .     S
C3646  H3659   1.099   .     S
C3646  C3647   1.385   .     S
C3647  H3657   1.100   .     S
C3647  C3648   1.429   .     S
C3648  C3649   1.428   .     S
C3648  C3651   1.383   .     S
C3649  H3658   1.100   .     S
C3649  C3650   1.385   .     S
C3650  H3660   1.100   .     S
C3651  N3652   1.352   .     S
C3651  N3656   1.352   .     S
N3652  C3653   1.350   .     S
C3653  C3664   1.382   .     S
C3653  N3654   1.352   .     S
N3654  C3655   1.351   .     S
C3655  N3656   1.352   .     S
C3661  C3666   1.401   .     S
C3661  C3662   1.401   .     S
C3661  H3698   1.100   .     S
C3662  H3669   1.100   .     S
C3662  C3663   1.385   .     S
C3663  C3664   1.429   .     S
C3663  H3667   1.100   .     S
C3664  C3665   1.429   .     S
C3665  H3668   1.099   .     S
C3665  C3666   1.384   .     S
C3666  H3670   1.099   .     S
C3671  H3699   1.099   .     S
C3671  C3672   1.400   .     S
C3671  C3676   1.401   .     S
C3672  C3673   1.385   .     S
C3672  H3679   1.100   .     S
C3673  C3674   1.430   .     S
C3673  H3677   1.100   .     S
C3674  C3675   1.428   .     S
C3674  C3685   1.382   .     S
C3675  C3676   1.385   .     S
C3675  H3678   1.099   .     S
C3676  H3680   1.100   .     S
C3681  N3686   1.351   .     S
C3681  N3682   1.351   .     S
N3682  C3683   1.352   .     S
C3683  C3690   1.386   .     S
C3683  N3684   1.351   .     S
N3684  C3685   1.352   .     S
C3685  N3686   1.352   .     S
C3687  C3688   1.434   .     S
C3687  C3692   1.434   .     S
C3688  C3689   1.367   .     S
C3688  H3695   1.101   .     S
C3689  H3693   1.100   .     S
C3689  C3690   1.428   .     S
C3690  C3691   1.428   .     S
C3691  H3694   1.100   .     S
C3691  C3692   1.368   .     S
C3692  H3696   1.101   .     S
C3700  C3708   1.440   .     S
C3700  C3705   1.434   .     S
C3700  C3701   1.434   .     S
C3701  C3702   1.367   .     S
C3701  H3714   1.101   .     S
C3702  C3703   1.427   .     S
C3702  H3706   1.100   .     S
C3703  C3704   1.427   .     S
C3703  C3730   1.385   .     S
C3704  H3707   1.100   .     S
C3704  C3705   1.368   .     S
C3705  H3715   1.101   .     S
C3708  C3713   1.434   .     S
C3708  C3709   1.435   .     S
C3709  H3716   1.101   .     S
C3709  C3710   1.368   .     S
C3710  H3717   1.100   .     S
C3710  C3711   1.428   .     S
C3711  C3756   1.384   .     S
C3711  C3712   1.428   .     S
C3712  H3718   1.101   .     S
C3712  C3713   1.366   .     S
C3713  H3719   1.101   .     S
C3720  C3721   1.399   .     S
C3720  H3772   1.100   .     S
C3720  C3725   1.401   .     S
C3721  H3734   1.100   .     S
C3721  C3722   1.385   .     S
C3722  H3732   1.099   .     S
C3722  C3723   1.429   .     S
C3723  C3726   1.383   .     S
C3723  C3724   1.428   .     S
C3724  C3725   1.385   .     S
C3724  H3733   1.100   .     S
C3725  H3735   1.099   .     S
C3726  N3727   1.351   .     S
C3726  N3731   1.351   .     S
N3727  C3728   1.352   .     S
C3728  C3739   1.382   .     S
C3728  N3729   1.352   .     S
N3729  C3730   1.350   .     S
C3730  N3731   1.351   .     S
C3736  C3741   1.401   .     S
C3736  C3737   1.400   .     S
C3736  H3773   1.099   .     S
C3737  H3744   1.099   .     S
C3737  C3738   1.385   .     S
C3738  C3739   1.429   .     S
C3738  H3742   1.099   .     S
C3739  C3740   1.429   .     S
C3740  H3743   1.099   .     S
C3740  C3741   1.384   .     S
C3741  H3745   1.099   .     S
C3746  C3747   1.400   .     S
C3746  C3751   1.401   .     S
C3746  H3774   1.099   .     S
C3747  C3748   1.384   .     S
C3747  H3754   1.100   .     S
C3748  H3752   1.100   .     S
C3748  C3749   1.430   .     S
C3749  C3750   1.429   .     S
C3749  C3760   1.382   .     S
C3750  H3753   1.099   .     S
C3750  C3751   1.385   .     S
C3751  H3755   1.100   .     S
C3756  N3757   1.351   .     S
C3756  N3761   1.351   .     S
N3757  C3758   1.350   .     S
C3758  C3765   1.386   .     S
C3758  N3759   1.350   .     S
N3759  C3760   1.352   .     S
C3760  N3761   1.352   .     S
C3762  C3763   1.436   .     S
C3762  C3767   1.435   .     S
C3763  C3764   1.367   .     S
C3763  H3770   1.101   .     S
C3764  H3768   1.100   .     S
C3764  C3765   1.428   .     S
C3765  C3766   1.428   .     S
C3766  C3767   1.367   .     S
C3766  H3769   1.100   .     S
C3767  H3771   1.101   .     S
C3775  C3780   1.435   .     S
C3775  C3776   1.434   .     S
C3775  C3783   1.441   .     S
C3776  C3777   1.369   .     S
C3776  H3789   1.100   .     S
C3777  C3778   1.428   .     S
C3777  H3781   1.099   .     S
C3778  C3779   1.427   .     S
C3778  C3805   1.386   .     S
C3779  H3782   1.100   .     S
C3779  C3780   1.368   .     S
C3780  H3790   1.101   .     S
C3783  C3784   1.435   .     S
C3783  C3788   1.434   .     S
C3784  H3791   1.101   .     S
C3784  C3785   1.368   .     S
C3785  C3786   1.429   .     S
C3785  H3792   1.099   .     S
C3786  C3831   1.386   .     S
C3786  C3787   1.428   .     S
C3787  H3793   1.100   .     S
C3787  C3788   1.368   .     S
C3788  H3794   1.102   .     S
C3795  C3796   1.401   .     S
C3795  C3800   1.400   .     S
C3795  H3847   1.100   .     S
C3796  C3797   1.384   .     S
C3796  H3809   1.100   .     S
C3797  H3807   1.100   .     S
C3797  C3798   1.428   .     S
C3798  C3799   1.429   .     S
C3798  C3801   1.383   .     S
C3799  C3800   1.384   .     S
C3799  H3808   1.099   .     S
C3800  H3810   1.100   .     S
C3801  N3802   1.351   .     S
C3801  N3806   1.352   .     S
N3802  C3803   1.351   .     S
C3803  C3814   1.382   .     S
C3803  N3804   1.352   .     S
N3804  C3805   1.352   .     S
C3805  N3806   1.350   .     S
C3811  C3812   1.400   .     S
C3811  C3816   1.401   .     S
C3811  H3848   1.100   .     S
C3812  C3813   1.384   .     S
C3812  H3819   1.099   .     S
C3813  H3817   1.100   .     S
C3813  C3814   1.429   .     S
C3814  C3815   1.429   .     S
C3815  H3818   1.100   .     S
C3815  C3816   1.384   .     S
C3816  H3820   1.099   .     S
C3821  C3826   1.400   .     S
C3821  C3822   1.400   .     S
C3821  H3849   1.100   .     S
C3822  H3829   1.100   .     S
C3822  C3823   1.385   .     S
C3823  H3827   1.099   .     S
C3823  C3824   1.429   .     S
C3824  C3825   1.429   .     S
C3824  C3835   1.383   .     S
C3825  H3828   1.099   .     S
C3825  C3826   1.385   .     S
C3826  H3830   1.100   .     S
C3831  N3832   1.351   .     S
C3831  N3836   1.352   .     S
N3832  C3833   1.350   .     S
C3833  C3840   1.385   .     S
C3833  N3834   1.350   .     S
N3834  C3835   1.352   .     S
C3835  N3836   1.352   .     S
C3837  C3838   1.436   .     S
C3837  C3842   1.438   .     S
C3838  C3839   1.367   .     S
C3838  H3845   1.102   .     S
C3839  C3840   1.428   .     S
C3839  H3843   1.100   .     S
C3840  C3841   1.428   .     S
C3841  C3842   1.367   .     S
C3841  H3844   1.099   .     S
C3842  H3846   1.101   .     S
C3850  C3851   1.436   .     S
C3850  C3855   1.435   .     S
C3850  C3858   1.438   .     S
C3851  H3864   1.100   .     S
C3851  C3852   1.368   .     S
C3852  C3853   1.428   .     S
C3852  H3856   1.099   .     S
C3853  C3880   1.385   .     S
C3853  C3854   1.428   .     S
C3854  H3857   1.100   .     S
C3854  C3855   1.367   .     S
C3855  H3865   1.101   .     S
C3858  C3859   1.435   .     S
C3858  C3863   1.435   .     S
C3859  H3866   1.101   .     S
C3859  C3860   1.368   .     S
C3860  C3861   1.428   .     S
C3860  H3867   1.100   .     S
C3861  C3862   1.428   .     S
C3861  C3906   1.385   .     S
C3862  C3863   1.368   .     S
C3862  H3868   1.100   .     S
C3863  H3869   1.101   .     S
C3870  C3871   1.400   .     S
C3870  H3922   1.099   .     S
C3870  C3875   1.401   .     S
C3871  C3872   1.384   .     S
C3871  H3884   1.100   .     S
C3872  C3873   1.429   .     S
C3872  H3882   1.099   .     S
C3873  C3876   1.383   .     S
C3873  C3874   1.428   .     S
C3874  C3875   1.385   .     S
C3874  H3883   1.100   .     S
C3875  H3885   1.099   .     S
C3876  N3877   1.351   .     S
C3876  N3881   1.351   .     S
N3877  C3878   1.350   .     S
C3878  N3879   1.352   .     S
C3878  C3889   1.383   .     S
N3879  C3880   1.351   .     S
C3880  N3881   1.351   .     S
C3886  C3891   1.401   .     S
C3886  C3887   1.400   .     S
C3886  H3923   1.099   .     S
C3887  C3888   1.385   .     S
C3887  H3894   1.100   .     S
C3888  C3889   1.429   .     S
C3888  H3892   1.099   .     S
C3889  C3890   1.428   .     S
C3890  H3893   1.099   .     S
C3890  C3891   1.384   .     S
C3891  H3895   1.099   .     S
C3896  H3924   1.099   .     S
C3896  C3901   1.400   .     S
C3896  C3897   1.400   .     S
C3897  H3904   1.100   .     S
C3897  C3898   1.384   .     S
C3898  H3902   1.100   .     S
C3898  C3899   1.429   .     S
C3899  C3910   1.383   .     S
C3899  C3900   1.429   .     S
C3900  C3901   1.385   .     S
C3900  H3903   1.099   .     S
C3901  H3905   1.099   .     S
C3906  N3911   1.351   .     S
C3906  N3907   1.351   .     S
N3907  C3908   1.351   .     S
C3908  N3909   1.351   .     S
C3908  C3915   1.385   .     S
N3909  C3910   1.352   .     S
C3910  N3911   1.352   .     S
C3912  C3913   1.435   .     S
C3912  C3917   1.432   .     S
C3913  H3920   1.101   .     S
C3913  C3914   1.368   .     S
C3914  H3918   1.100   .     S
C3914  C3915   1.428   .     S
C3915  C3916   1.427   .     S
C3916  C3917   1.368   .     S
C3916  H3919   1.100   .     S
C3917  H3921   1.101   .     S
