331
Energy = -7884.306880124
N     3.5500125   14.0194187   -8.9834533 
N    -4.7862397    7.7998537    0.0470548 
H    -5.7017830    7.7777246   -0.4567421 
N     0.1816104    4.4593956   -3.0384660 
H     0.9287948    3.8628996   -3.3847551 
C    -4.3738384    6.6215605    0.4945412 
O    -3.1818118    6.3260385    0.7379546 
C    -5.4691797    5.6222762    0.8414780 
H    -5.7463163    5.8136172    1.8994839 
H    -6.3544348    5.7747592    0.2022974 
O    -4.9419872    4.3130207    0.6974831 
C    -5.6339586    3.2731363    1.3704107 
H    -6.6515807    3.5980814    1.6380207 
H    -5.7012686    2.3976637    0.6976729 
C    -4.7941966    2.8467101    2.5790372 
O    -3.5762070    3.1218925    2.5456281 
N    -5.3352656    2.1707709    3.5974048 
H     3.7924940   13.0357402   -9.0715919 
C     3.4039013   14.6472376  -10.1948831 
C    -0.0807748    4.4381630   -1.7216354 
O    -1.0304053    5.0584735   -1.2180277 
C     3.0787095   16.1495291  -10.1395127 
H     2.2724786   16.3572661   -9.4046469 
H     3.9873606   16.6822706   -9.7755213 
C     0.8399116    3.6093845   -0.8414568 
H     0.7791619    2.5377644   -1.1184192 
H     1.8862717    3.9577555   -0.9614822 
O     0.3996591    3.8278703    0.4890972 
O     2.7165707   16.5837412  -11.4128860 
C     2.8243110   17.9745572  -11.5983455 
H     2.1715332   18.5271047  -10.8965803 
H     3.8723893   18.3071589  -11.4208967 
C     0.9688308    3.0094154    1.4948155 
H     1.9327468    2.5972688    1.1639294 
H     1.1106454    3.6498829    2.3812914 
C    -0.0276495    1.9084576    1.8707519 
O    -1.1863449    1.9896337    1.4089525 
N     0.3510934    0.9718390    2.7483254 
C     2.3816726   18.4340094  -12.9972275 
O     1.5761573   19.3542706  -13.0698198 
N     2.9403137   17.8669650  -14.1098077 
O     3.5614280   14.0620125  -11.2478926 
C     2.5127948   18.4218734  -15.3990613 
C     3.1786778   19.7542382  -15.7744242 
H     1.4206671   18.5723027  -15.3578684 
H     2.7214416   17.6620564  -16.1723919 
C     2.6818930   20.3050963  -17.1164063 
H     2.9640183   20.4841793  -14.9741142 
H     4.2774601   19.6254870  -15.8117714 
C     3.3141672   21.6500342  -17.4881528 
H     2.8865995   19.5679440  -17.9184937 
H     1.5806121   20.4154537  -17.0778045 
H     2.9332779   22.0221477  -18.4564343 
H     4.4145422   21.5679806  -17.5703978 
C     3.9166755   16.7716568  -14.1007250 
C     5.3889469   17.2102064  -14.1479790 
H     3.6999188   16.1350101  -14.9773276 
H     3.7405091   16.1455726  -13.2162512 
C     6.3484860   16.0128746  -14.1431678 
H     5.5735298   17.8295682  -15.0463473 
H     5.6035506   17.8611011  -13.2777653 
C     7.8258011   16.4159896  -14.1429021 
H     6.1326071   15.3781626  -13.2622589 
H     6.1403217   15.3784517  -15.0269493 
H     8.0753785   17.0306926  -15.0282655 
H     8.0805235   17.0110606  -13.2455387 
C    -4.4386082    1.7315264    4.6845685 
C    -4.1296174    2.8110890    5.7302248 
H    -3.4985906    1.3987295    4.2166415 
H    -4.9101288    0.8525583    5.1540567 
C    -3.0471615    2.3641549    6.7223487 
H    -3.7793986    3.7220133    5.2155979 
H    -5.0535151    3.0795701    6.2783011 
C    -2.6514610    3.4737625    7.7005765 
H    -3.3911876    1.4676792    7.2780481 
H    -2.1488490    2.0603389    6.1518782 
H    -1.8829330    3.1236306    8.4134557 
H    -3.5212154    3.8247796    8.2880015 
C    -6.7510793    1.7827889    3.6305863 
C    -7.6565625    2.7546314    4.3984749 
H    -6.7967094    0.7822604    4.0918090 
H    -7.1048128    1.6337685    2.6002175 
C    -9.1228804    2.3041368    4.4098383 
H    -7.2902119    2.8585113    5.4368236 
H    -7.5811258    3.7632106    3.9468616 
C   -10.0434976    3.2614899    5.1722192 
H    -9.4809831    2.1979118    3.3670236 
H    -9.1896685    1.2927788    4.8571469 
H    -9.7336824    3.3588226    6.2293884 
H   -10.0287101    4.2736511    4.7268316 
C    -0.6180888   -0.0251675    3.2191362 
C    -0.2827225   -1.4674571    2.8214111 
H    -1.5926905    0.2612367    2.7995027 
H    -0.6849576    0.0691006    4.3207809 
C    -1.3542213   -2.4535003    3.3009668 
H    -0.1805408   -1.5094663    1.7216993 
H     0.6887729   -1.7650397    3.2590320 
C    -1.0102400   -3.9117474    2.9828439 
H    -1.5003022   -2.3426432    4.3943917 
H    -2.3236084   -2.1901008    2.8349692 
H    -0.8884373   -4.0643103    1.8948661 
H    -0.0627529   -4.2142754    3.4672280 
C     1.7070220    0.9395050    3.3137992 
C     2.7630928    0.1921562    2.4834350 
H     1.6193796    0.4737410    4.3102066 
H     2.0371012    1.9743282    3.5042688 
C     4.1583556    0.2912030    3.1128171 
H     2.4723181   -0.8675671    2.3835121 
H     2.7772511    0.5810398    1.4507601 
C     5.2288085   -0.4695794    2.3247560 
H     4.4508298    1.3571161    3.1961455 
H     4.1232636   -0.0933024    4.1514958 
H     4.9877765   -1.5469678    2.2594938 
H     5.3105535   -0.0869914    1.2902268 
C    -0.6493373    5.1789374   -4.0056837 
H    -1.5089041    5.5630191   -3.4372323 
H    -1.0397044    4.4589609   -4.7464912 
C     0.0770599    6.3265179   -4.7203231 
H    -0.6850657    6.9149938   -5.2616889 
H     0.7718160    5.9390491   -5.4889523 
C     3.4317290   14.5883516   -7.6474013 
H     3.6583078   15.6646533   -7.6948702 
H     4.2280450   14.1472515   -7.0185879 
C     2.0674839   14.3868581   -6.9697335 
H     2.0246983   15.0113366   -6.0586748 
H     1.2593679   14.7358074   -7.6377401 
C    -3.8921388    8.9218764   -0.1936921 
H    -2.9218224    8.6785491    0.2672566 
H    -4.3012116    9.8015383    0.3397166 
C    -3.7165304    9.2645616   -1.6804928 
H    -3.2805289    8.4008020   -2.2122635 
H    -4.7001134    9.4588157   -2.1452890 
C     0.1356850   11.7830256   -5.2764304 
C    -1.0840424   11.8892054   -4.5881522 
C    -1.5330941   10.8141170   -3.8221166 
C    -0.7907917    9.6189806   -3.7445851 
C     0.4255277    9.5318873   -4.4324327 
C     0.8924657   10.6082960   -5.2079726 
H    -1.6584038   12.8155343   -4.6282785 
H    -1.1865537    8.7834426   -3.1703275 
H     1.8408301   10.4835889   -5.7293950 
N    -0.1488238    0.1805698   -0.9332123 
N    -1.3200985    4.7691918    3.9328527 
N    -6.4972948    6.4198995   -2.4257878 
O     0.9351792    0.4829593   -0.3776932 
O    -0.5685292    0.8936046   -1.8795919 
O    -0.8008149   -0.8097668   -0.5496920 
O    -1.1642677    4.9286994    2.6434898 
O    -0.5468936    4.0053476    4.5051585 
O    -2.2112877    5.3949410    4.4916007 
O    -7.1880413    6.0899841   -3.3847510 
O    -6.9400792    7.2472202   -1.5773527 
O    -5.3368130    5.9384200   -2.2546851 
Am   -2.2453084    4.1200160    0.7565607 
N    -4.6059400    3.2582001   -2.9775211 
N    -5.1657500   11.3759389  -13.9013883 
H    -5.1709236   12.2097718  -13.3236944 
N     0.6290435    4.9780730  -14.1042477 
H     1.4390618    5.2889295  -14.6368069 
C    -5.9486141   11.3384549  -15.0257104 
O    -6.0110882   10.3859227  -15.7746551 
C    -6.7911632   12.6062572  -15.2310301 
H    -7.7477601   12.4726481  -14.6772858 
H    -6.2835944   13.4939452  -14.7900556 
O    -7.0280078   12.7841493  -16.5958225 
C    -7.9067032   13.8480952  -16.8860565 
H    -8.8626888   13.7275682  -16.3436143 
H    -7.4609437   14.8232594  -16.5846382 
C    -8.2815823   13.8618199  -18.3764782 
O    -9.4526075   13.7105077  -18.6960841 
N    -7.2953242   14.0713631  -19.3027711 
H    -4.7459261    4.2755753   -2.8029220 
C    -3.8488325    2.6124410   -2.0913987 
C    -0.0619575    3.9396892  -14.6405010 
O    -1.1355906    3.5284385  -14.2286304 
C    -3.7780968    1.0938616   -2.0552508 
H    -4.2678559    0.6125398   -2.9228094 
H    -2.7047435    0.8158463   -2.0431025 
C     0.6158750    3.2712015  -15.8404953 
H     1.0639128    2.3079424  -15.5114651 
H    -0.1884174    3.0303921  -16.5636841 
O     1.5759862    4.1353493  -16.3925961 
O    -4.4310436    0.7209618   -0.8562017 
C    -4.1445720   -0.6019113   -0.4840321 
H    -4.4163295   -1.2998664   -1.3041278 
H    -3.0560799   -0.7225053   -0.3052678 
C     1.9833482    3.8629205  -17.7036007 
H     2.7794409    3.0865652  -17.7264554 
H     1.1316221    3.4710641  -18.2914185 
C     2.5333158    5.1707413  -18.3061424 
O     2.9441980    6.0490799  -17.5687983 
N     2.5253152    5.2885871  -19.6787186 
C    -4.9535462   -0.9494674    0.7676291 
O    -5.6402750   -0.1050513    1.3310858 
N    -4.8527261   -2.2452836    1.2137789 
O    -3.1908582    3.2309720   -1.2240155 
C    -5.5561415   -2.6110520    2.4439890 
C    -6.7707714   -3.5312568    2.2575153 
H    -5.8844573   -1.6689151    2.9066760 
H    -4.8308869   -3.0891100    3.1306293 
C    -7.5495270   -3.7398616    3.5625342 
H    -7.4376793   -3.0955988    1.4892745 
H    -6.4458264   -4.5156598    1.8708729 
C    -8.7138171   -4.7245417    3.4218004 
H    -6.8570388   -4.0999858    4.3492008 
H    -7.9305733   -2.7624920    3.9184590 
H    -9.2604817   -4.8423084    4.3747625 
H    -8.3558282   -5.7256793    3.1157801 
C    -4.0011012   -3.2521251    0.5700768 
C    -4.6528700   -4.0811173   -0.5501827 
H    -3.6560256   -3.9364263    1.3649778 
H    -3.0907641   -2.7668994    0.1820078 
C    -3.6634312   -5.0752019   -1.1731453 
H    -5.5285824   -4.6255616   -0.1534015 
H    -5.0409263   -3.4066949   -1.3363919 
C    -4.2772308   -5.9294629   -2.2857916 
H    -2.7914314   -4.5209943   -1.5713902 
H    -3.2636614   -5.7368680   -0.3794114 
H    -5.1259862   -6.5318235   -1.9103342 
H    -4.6559624   -5.3009788   -3.1132269 
C    -7.7018762   14.0503043  -20.7114110 
C    -8.3856394   15.3331008  -21.2078014 
H    -8.3968012   13.2044328  -20.8481570 
H    -6.7985332   13.8445109  -21.3126002 
C    -8.8041060   15.2406342  -22.6804494 
H    -9.2762621   15.5142571  -20.5807451 
H    -7.7082983   16.1973421  -21.0681914 
C    -9.5102900   16.5006687  -23.1899565 
H    -7.9117399   15.0402688  -23.3071589 
H    -9.4716692   14.3669280  -22.8135450 
H    -9.8043636   16.3984447  -24.2504557 
H    -8.8562297   17.3892997  -23.1078606 
C    -5.8841906   14.2783392  -18.9792204 
C    -5.4184299   15.7414818  -19.0340990 
H    -5.2838840   13.6765200  -19.6870967 
H    -5.6884019   13.8508397  -17.9863346 
C    -3.9372203   15.9035771  -18.6690397 
H    -5.5929387   16.1529661  -20.0466505 
H    -6.0415159   16.3450194  -18.3456243 
C    -3.4567643   17.3565214  -18.7113933 
H    -3.7619512   15.4858460  -17.6577285 
H    -3.3226450   15.2919162  -19.3585978 
H    -3.5865532   17.7923560  -19.7200713 
H    -4.0236129   17.9879057  -18.0018501 
C     2.9583594    6.5683250  -20.2490731 
C     4.3553306    6.5619540  -20.8844718 
H     2.9345951    7.3023434  -19.4301147 
H     2.2081718    6.8759655  -21.0022138 
C     4.7391121    7.9363424  -21.4476017 
H     5.0933701    6.2470842  -20.1227073 
H     4.4001718    5.8120236  -21.6983731 
C     6.1213243    7.9631363  -22.1064600 
H     3.9750173    8.2530964  -22.1848909 
H     4.7030748    8.6853984  -20.6328233 
H     6.9163373    7.7003190  -21.3840627 
H     6.1812038    7.2428163  -22.9443964 
C     2.0628060    4.2495159  -20.5999406 
C     3.0628245    3.1166880  -20.8864826 
H     1.8119138    4.7529391  -21.5493444 
H     1.1128331    3.8161714  -20.2385293 
C     2.5028966    2.0748671  -21.8632276 
H     3.9948648    3.5496991  -21.2935967 
H     3.3448785    2.6180070  -19.9396353 
C     3.4946595    0.9552480  -22.1930602 
H     1.5789324    1.6353506  -21.4383700 
H     2.1939607    2.5802664  -22.7994086 
H     4.4093351    1.3568233  -22.6676208 
H     3.8047239    0.4114354  -21.2812135 
C     0.0479253    5.8916578  -13.1264477 
H    -0.9784679    6.1534017  -13.4503296 
H     0.6491592    6.8143451  -13.1741482 
C     0.0019221    5.4158582  -11.6628714 
H    -0.2398900    6.3014959  -11.0474909 
H     1.0071474    5.0837423  -11.3447584 
C    -5.4999743    2.6692718   -3.9842442 
H    -6.4473455    2.3687427   -3.4983007 
H    -5.0397771    1.7562273   -4.3943132 
C    -5.8122546    3.6572687   -5.1083943 
H    -6.6480728    3.2476228   -5.7033183 
H    -6.1725862    4.6068364   -4.6765650 
C    -4.4026713   10.2280868  -13.4428399 
H    -3.3619588   10.5441129  -13.2369657 
H    -4.3746211    9.5228413  -14.2890204 
C    -5.0056364    9.5543141  -12.2034018 
H    -5.0698628   10.2754159  -11.3668140 
H    -6.0359865    9.2245785  -12.4243182 
C    -4.3414367    5.3087744   -8.0148616 
C    -4.8599338    6.3826419   -8.7520405 
C    -4.2218737    6.7812495   -9.9273054 
C    -3.0696600    6.1150533  -10.3850118 
C    -2.5575798    5.0465444   -9.6303349 
C    -3.1768928    4.6486828   -8.4327728 
H    -5.7614108    6.8940157   -8.4117433 
H    -2.5869817    6.4229666  -11.3088574 
H    -2.7501472    3.8038107   -7.8924101 
O    -5.0617895    4.9664205   -6.9178785 
O    -4.7854778    7.8345603  -10.5790819 
O    -1.4592272    4.3303025   -9.9945215 
O     0.5215888   12.8910511   -5.9655029 
O    -2.7148495   10.9722310   -3.1626017 
O     1.2512816    8.4470899   -4.4026255 
C    -4.1842524    8.3546566  -11.7461261 
H    -4.1513212    7.5844736  -12.5438427 
H    -3.1386393    8.6610355  -11.5343906 
C    -1.0436872    4.3263190  -11.3605199 
H    -0.6276256    3.3229069  -11.5379571 
H    -1.9191972    4.4233085  -12.0206375 
C    -4.6440388    3.9331691   -6.0504976 
H    -3.7382011    4.2494725   -5.4917479 
H    -4.3831912    3.0197308   -6.6229491 
C     0.8509573    7.2469985   -3.7672827 
H     1.7894629    6.7638832   -3.4479770 
H     0.2704565    7.4537112   -2.8502214 
C    -2.8379296   10.5084632   -1.8231700 
H    -3.2948330   11.3417146   -1.2561877 
H    -1.8343278   10.3295764   -1.3930735 
C     1.7987330   12.9417161   -6.5659349 
H     1.8361094   12.2669293   -7.4458106 
H     2.5750275   12.6041155   -5.8494680 
H     8.4854939   15.5295892  -14.1544014 
H     3.0953586   22.4184207  -16.7232154 
H   -10.4265035   16.7082832  -22.6061796 
H    -2.3866543   17.4363088  -18.4474689 
H     3.0521165    0.2193559  -22.8880924 
H     6.3536081    8.9650451  -22.5102403 
H     6.2219616   -0.3752384    2.7995352 
H    -1.7990710   -4.6008464    3.3372828 
H    -2.2378996    4.3343056    7.1463966 
H   -11.0894219    2.9062306    5.1596499 
H    -9.4383119   -4.3842341    2.6587566 
H    -3.5332316   -6.6272945   -2.7109863 
