1460
poly(1-2) s-cis 18-mer left-handed PM7 optimized
N      12.424400   -2.453900   -6.297100
C      12.192500   -3.712400   -5.845100
C      12.297300   -4.068700   -4.489500
C      12.664600   -3.078900   -3.563500
C      12.911000   -1.769800   -4.015500
C      12.766600   -1.499300   -5.388800
N      13.763700    0.089700   -6.958900
C      13.899000    1.352300   -7.438600
C      13.260100    2.462700   -6.866900
C      12.440700    2.256500   -5.742500
C      12.252900    0.950500   -5.260500
C      12.936900   -0.105700   -5.896100
H      11.886500   -4.446200   -6.604100
H      12.082700   -5.085600   -4.167900
H      13.210600   -0.989900   -3.319900
H      14.555100    1.460900   -8.312100
H      13.401800    3.460100   -7.276800
H      11.592900    0.759200   -4.416700
C      12.772400   -3.389800   -2.183100
C      12.859200   -3.657300   -1.006000
C      12.974900   -3.975200    0.370200
C      13.117600   -2.949800    1.321400
C      12.962900   -5.321200    0.781600
C      13.251900   -3.271000    2.683200
H      13.129100   -1.906300    1.002700
C      13.103000   -5.623500    2.138700
H      12.844400   -6.115200    0.042700
C      13.245600   -4.616300    3.097200
C      13.402600   -2.233500    3.639800
C      13.092700   -7.058100    2.587700
H      13.358700   -4.867900    4.156200
C      13.532100   -1.347500    4.448200
O      12.135500   -7.587500    3.139700
N      14.275800   -7.728800    2.321900
H      13.639800   -0.587100    5.141400
H      15.034500   -7.271500    1.797100
C      14.514400   -9.137000    2.734200
C      15.920600   -9.490300    2.232900
O      16.628300   -8.799400    1.532400
O      16.314200  -10.718200    2.679600
C      17.648100  -11.154900    2.216100
H      18.386900  -10.544300    2.761400
H      17.718100  -10.946100    1.132600
C      17.714300  -12.638900    2.549400
H      17.706400  -12.788500    3.646800
H      16.806800  -13.154800    2.175900
C      18.978200  -13.243900    1.923900
H      19.868700  -12.661100    2.235000
H      18.928800  -13.153800    0.819800
C      19.172100  -14.716000    2.309800
H      19.239500  -14.816000    3.410200
H      18.289500  -15.310800    2.005700
C      20.439000  -15.281200    1.652000
H      21.314300  -14.662000    1.930700
H      20.355000  -15.203500    0.550100
C      20.695000  -16.741300    2.047900
H      20.780700  -16.826700    3.148100
H      19.829600  -17.369600    1.762800
C      21.971300  -17.273000    1.380500
H      21.879100  -17.195000    0.279700
H      22.832700  -16.634000    1.656000
C      22.259500  -18.727800    1.774400
H      21.404300  -19.372100    1.494000
H      22.351500  -18.810700    2.874300
C      23.541600  -19.239800    1.103000
H      23.447200  -19.159600    0.002700
H      24.395300  -18.591200    1.379700
C      23.844300  -20.692100    1.494400
H      22.994400  -21.344300    1.216100
H      23.939300  -20.776100    2.593900
C      25.129000  -21.197400    0.821900
H      25.034100  -21.117200   -0.278800
H      25.980500  -20.545700    1.099800
C      25.439600  -22.641800    1.207400
H      26.357400  -22.992400    0.722000
H      24.632400  -23.321400    0.911400
H      25.578800  -22.750400    2.289000
C      11.860600    3.362400   -5.069300
C      11.427200    4.315800   -4.463200
C      10.983200    5.435500   -3.715700
C      10.849400    5.319800   -2.320000
C      10.736700    6.666500   -4.352000
C      10.484700    6.441400   -1.556300
H      11.041600    4.364000   -1.830000
C      10.373600    7.771600   -3.576800
H      10.839900    6.758600   -5.437500
C      10.400600    6.350900   -0.144700
C      10.238900    7.674600   -2.189500
C      10.133800    9.096600   -4.247000
C      10.354000    6.295100    1.063100
H       9.950300    8.543400   -1.595400
O       9.088100    9.391300   -4.812000
N      11.216500    9.956700   -4.156600
C      10.298900    6.237400    2.479900
H      12.053900    9.694200   -3.617900
C      11.236800   11.301100   -4.791100
C       9.805300    7.326100    3.216900
C      10.729600    5.083700    3.159000
C      12.591700   11.919900   -4.422600
C       9.764300    7.223500    4.618000
H       9.448500    8.225100    2.718600
C      10.636000    5.061800    4.563100
H      11.128700    4.233700    2.611400
O      13.422800   11.439200   -3.683000
O      12.776900   13.121500   -5.042100
N      10.173300    6.116600    5.288400
H       9.365600    8.039700    5.237700
C      10.996800    3.823300    5.313800
C      14.040600   13.810700   -4.704300
N      11.839800    3.939400    6.375600
C      10.464100    2.586800    4.897100
H      14.855800   13.223400   -5.158700
H      14.145100   13.804800   -3.603900
C      13.892600   15.208600   -5.288900
C      12.141700    2.815900    7.075700
C      10.824900    1.428800    5.605100
H       9.785300    2.529100    4.048400
H      13.848300   15.161400   -6.394600
H      12.926600   15.653200   -4.974600
C      15.067000   16.080900   -4.825600
C      11.661100    1.544300    6.730400
H      12.801700    2.959100    7.941200
H      16.026500   15.582500   -5.070700
H      15.049500   16.176000   -3.720900
C      15.041200   17.477500   -5.460600
H      11.928200    0.668200    7.316900
H      15.075100   17.395300   -6.563800
H      14.087600   17.987400   -5.224600
C      16.224500   18.317500   -4.959100
H      17.174900   17.786000   -5.163200
H      16.169500   18.421700   -3.857500
C      16.263900   19.707900   -5.607200
H      16.319200   19.611900   -6.708400
H      15.322600   20.251400   -5.398500
C      17.461900   20.517700   -5.091300
H      17.397400   20.622800   -3.990800
H      18.400800   19.963500   -5.285700
C      17.537100   21.906000   -5.740500
H      16.603900   22.467400   -5.542700
H      17.601300   21.806100   -6.841000
C      18.743800   22.697200   -5.216700
H      18.676200   22.800500   -4.116400
H      19.675800   22.131500   -5.409100
C      18.836100   24.085200   -5.864200
H      17.907200   24.655400   -5.671800
H      18.904900   23.986100   -6.964500
C      20.046200   24.869700   -5.336700
H      19.976900   24.972700   -4.236000
H      20.976600   24.300200   -5.528700
C      20.148200   26.252200   -5.977100
H      21.014500   26.802900   -5.593200
H      19.258100   26.858300   -5.773800
H      20.257700   26.186200   -7.065500
C      10.400900    0.152700    5.156100
C      10.098700   -0.942400    4.739300
C       9.814800   -2.232700    4.226500
C       9.621100   -2.402400    2.843600
C       9.785100   -3.344400    5.088000
C       9.419300   -3.690200    2.319000
H       9.638900   -1.537900    2.179000
C       9.586200   -4.619700    4.549000
H       9.929400   -3.214600    6.165500
C       9.248800   -3.872700    0.927600
C       9.406000   -4.807900    3.176700
C       9.584900   -5.796700    5.484500
C       9.108500   -4.042500   -0.269500
H       9.262400   -5.809500    2.765600
O       8.677300   -6.028600    6.276800
N      10.729100   -6.569000    5.407700
C       8.927200   -4.272400   -1.654200
H      11.369800   -6.493300    4.594800
C      10.963600   -7.720300    6.312700
C       8.617500   -5.563900   -2.112400
C       9.037700   -3.219700   -2.580500
C      12.453000   -8.066700    6.184600
C       8.435400   -5.757800   -3.491600
H       8.506900   -6.392700   -1.416700
C       8.819700   -3.498800   -3.943800
H       9.292000   -2.217300   -2.246200
O      13.338100   -7.399100    5.697700
O      12.711000   -9.298800    6.727600
N       8.542200   -4.753800   -4.396000
H       8.170700   -6.743200   -3.900500
C       8.861100   -2.405000   -4.959400
C      14.092000   -9.784100    6.567000
N       9.388400   -2.706200   -6.178900
C       8.380700   -1.118800   -4.644700
H      14.771000   -9.033900    7.007300
H      14.282000   -9.863900    5.477100
C      14.107400  -11.122500    7.294100
C       9.459600   -1.726700   -7.113800
C       8.476300   -0.109300   -5.619000
H       7.936600   -0.907600   -3.675000
H      14.003000  -10.962800    8.385700
H      13.221000  -11.722300    7.001800
C      15.402600  -11.878600    6.974600
C       9.019100   -0.414800   -6.878600
H       9.909400   -2.016400   -8.074200
C       8.062100    1.216300   -5.331100
H      16.277200  -11.219900    7.147400
H      15.427600  -12.139400    5.897400
C      15.549800  -13.152200    7.818600
H       9.104100    0.347400   -7.650500
C       7.743400    2.360100   -5.098500
H      15.550000  -12.896300    8.895700
H      14.676800  -13.815400    7.666800
C      16.843700  -13.893700    7.454700
C       7.399300    3.705400   -4.815800
H      17.708500  -13.208600    7.555900
H      16.816600  -14.190200    6.388000
C      17.067600  -15.134200    8.329900
C       7.240700    4.117200   -3.480700
C       7.241100    4.629600   -5.865500
H      17.098400  -14.844900    9.397900
H      16.212600  -15.829800    8.231000
C      18.371500  -15.845900    7.942000
C       6.933200    5.458100   -3.194600
H       7.359300    3.398300   -2.669400
C       6.938800    5.961100   -5.563200
H       7.362000    4.310900   -6.905700
H      18.329900  -16.149100    6.877800
H      19.221200  -15.139900    8.021500
C      18.639600  -17.075700    8.819800
C       6.770700    5.878700   -1.851100
C       6.786300    6.388200   -4.241500
C       6.774200    6.939400   -6.693500
H      17.795700  -17.787700    8.743000
H      18.686200  -16.777800    9.884800
C      19.947800  -17.768200    8.412800
C       6.623500    6.243500   -0.707000
H       6.558400    7.432400   -4.016500
O       5.812600    6.932800   -7.455100
N       7.830500    7.822800   -6.825100
H      19.897600  -18.069000    7.348400
H      20.789300  -17.052000    8.484200
C      20.236900  -18.996400    9.285700
C       6.422100    6.689900    0.624500
H       8.506800    7.957700   -6.050600
C       7.880500    8.832000   -7.911200
H      19.398300  -19.715500    9.218000
H      20.292500  -18.699900   10.350600
C      21.545500  -19.682900    8.868000
C       5.936200    7.986300    0.862300
C       6.684300    5.840200    1.714000
C       9.301600    9.409600   -7.897200
H      21.489500  -19.983000    7.803300
H      22.385600  -18.964000    8.935300
C      21.845200  -20.905900    9.731700
C       5.735300    8.390300    2.192600
H       5.704900    8.657300    0.038200
C       6.435600    6.319500    3.014900
H       7.074400    4.839100    1.549700
O      10.276700    8.991600   -7.312500
O       9.372900   10.533400   -8.679000
H      22.779700  -21.388400    9.423800
H      21.049800  -21.656300    9.659600
H      21.947800  -20.638300   10.789400
N       5.987200    7.584000    3.252600
H       5.335500    9.385600    2.433600
C       6.635800    5.434000    4.200300
C      10.666100   11.237900   -8.657300
N       7.125000    6.009900    5.333900
C       6.337800    4.059500    4.122800
H      11.438200   10.537500   -9.018800
H      10.873400   11.508500   -7.601300
C      10.456700   12.439300   -9.570100
C       7.341100    5.224200    6.417600
C       6.583200    3.254700    5.249600
H       5.918500    3.626300    3.218000
H      10.341600   12.103100  -10.619900
H       9.500900   12.944100   -9.320300
C      11.634900   13.411300   -9.433600
C       7.088300    3.843500    6.421100
H       7.752600    5.733200    7.300600
H      12.592100   12.860600   -9.530400
H      11.640100   13.851800   -8.416300
C      11.585600   14.531600  -10.481700
H       7.286400    3.243600    7.307200
H      11.600200   14.099300  -11.500800
H      10.631800   15.087900  -10.404400
C      12.770600   15.490600  -10.300300
H      13.719500   14.918800  -10.312000
H      12.716400   15.965400   -9.301300
C      12.813200   16.574800  -11.385700
H      12.868200   16.107400  -12.387500
H      11.873700   17.159600  -11.377600
C      14.014700   17.507200  -11.175700
H      13.946600   17.986500  -10.179800
H      14.950300   16.914600  -11.161900
C      14.104400   18.586100  -12.263200
H      13.173500   19.184500  -12.281600
H      14.177800   18.112900  -13.261200
C      15.312600   19.504100  -12.029600
H      15.235900   19.978200  -11.031900
H      16.242100   18.902600  -12.006500
C      15.422600   20.586700  -13.111200
H      14.495400   21.190500  -13.139200
H      15.505400   20.117800  -14.110400
C      16.631400   21.501200  -12.864900
H      16.548900   21.973100  -11.866200
H      17.560200   20.898100  -12.838200
C      16.751700   22.582900  -13.935900
H      17.616300   23.230000  -13.749700
H      15.863300   23.224000  -13.964600
H      16.875700   22.150300  -14.935200
C       6.356000    1.855500    5.202900
C       6.196900    0.656300    5.177500
C       6.036000   -0.751200    5.140900
C       5.896400   -1.405000    3.903700
C       6.035800   -1.492000    6.337600
C       5.764800   -2.803200    3.863500
H       5.892200   -0.828600    2.978300
C       5.906200   -2.883200    6.279700
H       6.142400   -0.985400    7.302100
C       5.620600   -3.470300    2.621600
C       5.774400   -3.548700    5.058500
C       5.893300   -3.660600    7.567500
C       5.489100   -4.050700    1.568100
H       5.679000   -4.635900    5.024700
O       4.940200   -3.651100    8.342000
N       7.059600   -4.353400    7.822300
C       5.313500   -4.764800    0.354800
H       7.762400   -4.517300    7.074400
C       7.251100   -5.132300    9.070900
C       5.049900   -6.144000    0.393000
C       5.381400   -4.108200   -0.887000
C       8.747400   -5.465200    9.145100
C       4.876200   -6.822800   -0.824300
H       4.968000   -6.672500    1.339800
C       5.171100   -4.860400   -2.059800
H       5.596900   -3.044000   -0.932800
O       9.665600   -4.931500    8.566000
O       8.964100   -6.500000   10.021500
N       4.946900   -6.204800   -2.027700
H       4.648900   -7.897800   -0.852400
C       5.165100   -4.200800   -3.400100
C      10.346600   -6.998900   10.086900
N       5.550600   -4.954600   -4.468800
C       4.780400   -2.852400   -3.535200
H      11.012100   -6.145100   10.302900
H      10.584300   -7.413400    9.084800
C      10.317500   -8.044600   11.195000
C       5.589900   -4.373700   -5.692000
C       4.829700   -2.261900   -4.811000
H       4.440800   -2.276000   -2.678500
H      10.144900   -7.554400   12.173800
H       9.450500   -8.722100   11.052500
C      11.629300   -8.838500   11.205300
C       5.242100   -3.030900   -5.911600
H       5.931300   -5.017000   -6.514600
C       4.485500   -0.897800   -4.991700
H      12.492100   -8.142600   11.192900
H      11.709800   -9.438300   10.276500
C      11.738300   -9.761100   12.427500
H       5.296600   -2.597400   -6.908100
C       4.210600    0.267200   -5.169500
H      11.692200   -9.164600   13.359000
H      10.871800  -10.448700   12.467100
C      13.046000  -10.564200   12.381300
C       3.901300    1.634600   -5.375800
H      13.905400   -9.872800   12.277100
H      13.059400  -11.201700   11.475900
C      13.239800  -11.436300   13.629400
C       3.703500    2.480400   -4.270100
C       3.801300    2.144400   -6.684200
H      13.237000  -10.804500   14.538200
H      12.387300  -12.132600   13.744500
C      14.554500  -12.224600   13.542400
C       3.411400    3.839700   -4.473700
H       3.776500    2.082600   -3.257800
C       3.512400    3.499900   -6.869400
H       3.953200    1.487400   -7.546400
H      14.543100  -12.872000   12.644200
H      15.401000  -11.524800   13.399200
C      14.799900  -13.079800   14.792700
C       3.199600    4.696200   -3.364600
C       3.320700    4.355100   -5.781200
C       3.387800    4.027900   -8.272400
H      13.959400  -13.784300   14.941800
H      14.817300  -12.437200   15.693700
C      16.119800  -13.855800   14.678000
C       3.004500    5.433200   -2.424900
H       3.101500    5.413400   -5.936800
O       2.443200    3.752600   -9.007200
N       4.445200    4.818100   -8.677900
H      16.096500  -14.504300   13.780900
H      16.957200  -13.149300   14.517400
C      16.391700  -14.706000   15.925800
C       2.747300    6.319500   -1.347500
H       5.119600    5.207000   -7.989200
C       4.511600    5.394800  -10.043700
H      15.558000  -15.414900   16.091000
H      16.419500  -14.061300   16.825000
C      17.713300  -15.477700   15.798500
C       2.297900    7.623800   -1.611300
C       2.917300    5.903600   -0.014700
C       5.940600    5.924300  -10.219900
H      17.684800  -16.126900   14.901600
H      18.548100  -14.768900   15.632000
C      17.997900  -16.324500   17.036900
C       2.046700    8.474600   -0.522300
H       2.134200    7.964200   -2.631100
C       2.618500    6.813000    1.019200
H       3.276100    4.901400    0.204400
O       6.926500    5.661900   -9.569300
O       6.003400    6.783200  -11.290000
H      18.942100  -16.871100   16.934300
H      17.208300  -17.064200   17.211000
H      18.073100  -15.707700   17.939700
N       2.213900    8.090100    0.765800
H       1.675700    9.498500   -0.670400
C       2.714900    6.399400    2.451500
C       7.296500    7.456600  -11.485600
N       2.997900    7.371400    3.364700
C       2.524800    5.054300    2.824900
H       8.077100    6.681900  -11.573200
H       7.479200    8.068900  -10.578400
C       7.108600    8.278400  -12.754500
C       3.127400    7.020400    4.666800
C       2.665600    4.704400    4.180000
H       2.263800    4.298000    2.089000
H       7.002400    7.605900  -13.628600
H       6.153900    8.840800  -12.702900
C       8.292200    9.235400  -12.941000
C       2.973900    5.700500    5.121100
H       3.380500    7.836400    5.357600
H       9.246200    8.681900  -12.830600
H       8.287600    9.996100  -12.134700
C       8.264200    9.931500  -14.308800
H       3.096500    5.456300    6.174300
H       8.291900    9.177500  -15.119000
H       7.311800   10.479700  -14.440500
C       9.450500   10.896000  -14.447300
H      10.396900   10.355300  -14.248600
H       9.383400   11.682900  -13.671000
C       9.514500   11.545400  -15.836600
H       9.586700   10.764300  -16.617600
H       8.575800   12.093200  -16.045000
C      10.713300   12.499400  -15.936600
H      10.626900   13.290100  -15.166400
H      11.647400   11.951900  -15.703600
C      10.825800   13.141400  -17.326000
H       9.895500   13.690600  -17.566600
H      10.920100   12.355600  -18.099800
C      12.028700   14.092700  -17.397200
H      11.930600   14.879900  -16.624900
H      12.956900   13.542000  -17.150400
C      12.162900   14.739000  -18.782400
H      11.236400   15.288600  -19.035800
H      12.268200   13.955700  -19.557400
C      13.365600   15.692100  -18.839700
H      13.260000   16.477700  -18.066100
H      14.293500   15.142300  -18.587300
C      13.511000   16.341000  -20.214200
H      14.371400   17.019500  -20.242100
H      12.623300   16.925600  -20.481400
H      13.658400   15.592400  -21.000900
C       2.517500    3.357900    4.600900
C       2.410100    2.215500    4.985200
C       2.295600    0.876300    5.434500
C       2.199500   -0.168800    4.498700
C       2.284800    0.595100    6.813800
C       2.099400   -1.497800    4.943600
H       2.201600    0.051600    3.431100
C       2.186800   -0.733300    7.239900
H       2.357000    1.407000    7.544100
C       1.988400   -2.555800    4.007400
C       2.099700   -1.783600    6.322700
C       2.151400   -1.018400    8.716600
C       1.879400   -3.466200    3.217600
H       2.031000   -2.818000    6.666100
O       1.180400   -0.756600    9.421900
N       3.316500   -1.561900    9.219300
C       1.729000   -4.558000    2.324200
H       4.034800   -1.969700    8.587400
C       3.475100   -1.871300   10.662100
C       1.492400   -5.844900    2.834900
C       1.795300   -4.368200    0.932300
C       4.966100   -2.158400   10.882600
C       1.344600   -6.904900    1.925300
H       1.412300   -6.016700    3.905800
C       1.612000   -5.482400    0.089000
H       1.989500   -3.379900    0.523800
O       5.901200   -1.876200   10.169100
O       5.156100   -2.808000   12.078100
N       1.415500   -6.738000    0.583100
H       1.140400   -7.928600    2.268600
C       1.610600   -5.325500   -1.397000
C       6.535100   -3.243400   12.349800
N       1.971400   -6.411000   -2.139400
C       1.257300   -4.098100   -1.991400
H       7.191600   -2.357700   12.291600
H       6.808900   -3.963900   11.549400
C       6.469700   -3.862300   13.740900
C       2.026900   -6.287000   -3.486900
C       1.316600   -3.985000   -3.392500
H       0.934300   -3.253400   -1.388500
H       6.284100   -3.074100   14.497300
H       5.597100   -4.543900   13.811400
C       7.770800   -4.615400   14.044400
C       1.712700   -5.093800   -4.158000
H       2.353900   -7.181200   -4.035200
C       0.996600   -2.761800   -4.035500
H       8.643000   -3.975700   13.801900
H       7.851600   -5.501600   13.383400
C       7.856600   -5.055500   15.512600
H       1.780200   -5.030300   -5.242000
C       0.739400   -1.727100   -4.608000
H       7.801800   -4.171800   16.177300
H       6.984900   -5.684700   15.775600
C       9.159300   -5.826500   15.770000
C       0.446600   -0.512400   -5.276400
H      10.024600   -5.218500   15.440100
H       9.179100   -6.742500   15.148100
C       9.330900   -6.201700   17.248300
C       0.224700    0.659000   -4.530400
C       0.382500   -0.479200   -6.682200
H       9.311900   -5.290100   17.875800
H       8.476200   -6.817900   17.586700
C      10.646700   -6.961900   17.468400
C      -0.056600    1.865900   -5.192500
H       0.270000    0.630200   -3.441700
C       0.104100    0.730800   -7.325700
H       0.553300   -1.389800   -7.264800
H      10.653900   -7.882600   16.853500
H      11.496600   -6.350800   17.106500
C      10.864000   -7.323700   18.943900
C      -0.297500    3.047300   -4.447700
C      -0.111000    1.904700   -6.599300
C       0.012800    0.746800   -8.827100
H      10.020000   -7.937900   19.312100
H      10.861000   -6.406100   19.563000
C      12.185800   -8.080500   19.137200
C      -0.519400    4.058800   -3.821800
H      -0.321200    2.845800   -7.111700
O      -0.915200    0.228400   -9.443100
N       1.077200    1.359700   -9.456700
H      12.185800   -8.998900   18.518800
H      13.027700   -7.465800   18.763900
C      12.423100   -8.445800   20.608400
C      -0.807100    5.259800   -3.123500
H       1.738900    1.964400   -8.929400
C       1.174300    1.431000  -10.935900
H      11.583700   -9.060000   20.986800
H      12.428400   -7.530000   21.230100
C      13.745800   -9.204600   20.789600
C      -1.227000    6.394100   -3.837700
C      -0.696300    5.326700   -1.723100
C       2.611100    1.864500  -11.254400
H      13.741000  -10.122100   20.169100
H      14.586700   -8.589600   20.413200
C      13.993000   -9.573700   22.250500
C      -1.509200    7.566700   -3.117900
H      -1.344000    6.363700   -4.918400
C      -1.021900    6.535900   -1.076800
H      -0.361200    4.460300   -1.158900
O       3.585900    1.823000  -10.538800
O       2.697700    2.320000  -12.547700
H      14.938600  -10.115200   22.367400
H      13.197100  -10.215100   22.645600
H      14.043700   -8.684500   22.889000
N      -1.398600    7.647700   -1.770500
H      -1.858000    8.477900   -3.623700
C      -0.981100    6.642100    0.413000
C       3.999500    2.885100  -12.934200
N      -0.758500    7.878100    0.944500
C      -1.157600    5.502000    1.221500
H       4.776300    2.127100  -12.735900
H       4.168400    3.769800  -12.285600
C       3.842600    3.225600  -14.410900
C      -0.668300    7.999700    2.290400
C      -1.063500    5.644000    2.618000
H      -1.372600    4.530300    0.784500
H       3.755000    2.295400  -15.006400
H       2.887900    3.766500  -14.574100
C       5.031400    4.069500  -14.886500
C      -0.810000    6.911500    3.167000
H      -0.456500    9.010700    2.664700
H       5.982100    3.594600  -14.571200
H       5.008100    5.060300  -14.389700
C       5.037100    4.254900  -16.410400
H      -0.719900    7.047800    4.242600
H       5.086600    3.269300  -16.912200
H       4.087300    4.715100  -16.743800
C       6.224700    5.125700  -16.844200
H       7.166700    4.695500  -16.450400
H       6.136900    6.130200  -16.386500
C       6.322200    5.259900  -18.370100
H       6.415300    4.259100  -18.833700
H       5.387800    5.693300  -18.774900
C       7.521200    6.134000  -18.764600
H       7.414200    7.140100  -18.314900
H       8.450300    5.709500  -18.336500
C       7.666900    6.261100  -20.287100
H       6.742100    6.685500  -20.722500
H       7.780800    5.258300  -20.741500
C       8.870300    7.141300  -20.653900
H       8.752300    8.145000  -20.201700
H       9.792900    6.718000  -20.211600
C       9.037700    7.273300  -22.173400
H       8.117300    7.694400  -22.621200
H       9.161800    6.272400  -22.629200
C      10.241100    8.159000  -22.528000
H      10.116400    9.161800  -22.074600
H      11.162800    7.737600  -22.080800
C      10.419300    8.296400  -24.038300
H      11.279600    8.931000  -24.279200
H       9.538100    8.745800  -24.510000
H      10.585600    7.324000  -24.515600
C      -1.206300    4.520500    3.472300
C      -1.314000    3.577300    4.222400
C      -1.431800    2.470300    5.099500
C      -1.499900    1.167700    4.574200
C      -1.475800    2.675700    6.491500
C      -1.607400    0.068700    5.443000
H      -1.470200    1.011200    3.495800
C      -1.579500    1.570900    7.342500
H      -1.424800    3.688600    6.902700
C      -1.692900   -1.246500    4.922400
C      -1.640800    0.270100    6.836700
C      -1.649000    1.804300    8.826900
C      -1.781300   -2.373400    4.490400
H      -1.715100   -0.586200    7.510200
O      -2.635200    2.284400    9.380400
N      -0.498300    1.468100    9.510800
C      -1.909000   -3.706600    4.022600
H       0.237200    0.879100    9.069800
C      -0.375000    1.667300   10.976200
C      -2.152200   -4.743200    4.939000
C      -1.813700   -4.004500    2.651600
C       1.112000    1.496100   11.312700
C      -2.279900   -6.051600    4.444600
H      -2.251500   -4.538700    6.002300
C      -1.976500   -5.341900    2.237700
H      -1.612900   -3.214200    1.932900
O       2.062800    1.537900   10.566300
O       1.275600    1.296100   12.662200
N      -2.182800   -6.353900    3.127900
H      -2.487600   -6.897800    5.114200
C      -1.941300   -5.702800    0.788300
C       2.646200    0.982500   13.094000
N      -1.555500   -6.971600    0.470400
C      -2.283200   -4.756700   -0.198100
H       3.312100    1.786700   12.738100
H       2.923300    0.025500   12.604000
C       2.555400    0.892700   14.612000
C      -1.460900   -7.313500   -0.836600
C      -2.183400   -5.127100   -1.551500
H      -2.627300   -3.761700    0.072100
H       2.351200    1.894700   15.038300
H       1.684400    0.270100   14.901800
C       3.852800    0.309000   15.184400
C      -1.760300   -6.424700   -1.882400
H      -1.112700   -8.335900   -1.038200
C      -2.488400   -4.200100   -2.581000
H       4.726700    0.842600   14.759800
H       3.958900   -0.747600   14.866600
C       3.899100    0.395900   16.716500
H      -1.660300   -6.733300   -2.920800
C      -2.731700   -3.424900   -3.477800
H       3.816700    1.451600   17.039100
H       3.025600   -0.122500   17.155800
C       5.200000   -0.217600   17.253300
C      -3.008100   -2.514300   -4.527800
H       6.069600    0.259300   16.759600
H       5.247500   -1.289400   16.978800
C       5.329700   -0.067800   18.775400
C      -3.250600   -1.161000   -4.233200
C      -3.034700   -2.964200   -5.861400
H       5.287000    1.002100   19.056100
H       4.468600   -0.546000   19.280000
C       6.642400   -0.688600   19.274100
C      -3.515200   -0.255600   -5.274700
H      -3.234000   -0.815300   -3.199400
C      -3.296900   -2.049900   -6.886600
H      -2.847500   -4.017400   -6.093100
H       6.672000   -1.763200   19.008900
H       7.499200   -0.224300   18.747600
C       6.819200   -0.524900   20.789700
C      -3.776100    1.107000   -4.985000
C      -3.531800   -0.700500   -6.610900
C      -3.348100   -2.548700   -8.304700
H       5.966800   -0.987400   21.323100
H       6.796800    0.548300   21.059700
C       8.137000   -1.155600   21.262000
C      -4.014300    2.269400   -4.748600
H      -3.728700    0.006600   -7.419400
O      -4.262000   -3.250600   -8.730900
N      -2.264000   -2.184100   -9.077200
H       8.155300   -2.229800   20.994500
H       8.987300   -0.695900   20.721800
C       8.336200   -0.994100   22.774700
C      -4.318700    3.634800   -4.512200
H      -1.615900   -1.429100   -8.773400
C      -2.128400   -2.624400  -10.487900
H       7.487800   -1.450200   23.319900
H       8.324400    0.078900   23.046100
C       9.654600   -1.632800   23.235600
C      -4.717900    4.451800   -5.582900
C      -4.245300    4.178900   -3.217600
C      -0.684500   -2.312300  -10.902000
H       9.666200   -2.707200   22.966600
H      10.504100   -1.175900   22.691100
C       9.865300   -1.477200   24.740000
C      -5.018400    5.797700   -5.316700
H      -4.805000    4.051900   -6.590200
C      -4.586700    5.534100   -3.034100
H      -3.926200    3.561500   -2.381900
O       0.271700   -2.095500  -10.193800
O      -0.566800   -2.327400  -12.270900
H      10.807700   -1.937600   25.057300
H       9.059900   -1.951500   25.312100
H       9.899800   -0.422600   25.036200
N      -4.944200    6.337000   -4.076500
H      -5.352500    6.477100   -6.113100
C      -4.585600    6.144900   -1.670700
C       0.742600   -1.914500  -12.798700
N      -4.374900    7.489700   -1.589200
C      -4.785700    5.349200   -0.525600
H       1.517100   -2.547000  -12.332100
H       0.890700   -0.857600  -12.492800
C       0.622800   -2.108600  -14.305100
C      -4.318900    8.065400   -0.364400
C      -4.727300    5.961400    0.739700
H      -4.991200    4.285100   -0.608600
H       0.555900   -3.188600  -14.543000
H      -0.330000   -1.671200  -14.667500
C       1.819300   -1.465200  -15.016500
C      -4.485600    7.341800    0.828000
H      -4.114000    9.144800   -0.353600
H       2.763900   -1.790000  -14.535900
H       1.779200   -0.364300  -14.892600
C       1.862000   -1.816700  -16.510300
H      -4.422100    7.838500    1.793900
H       1.927200   -2.914100  -16.640100
H       0.919400   -1.510500  -17.002900
C       3.057300   -1.135000  -17.191400
H       3.990800   -1.393000  -16.653500
H       2.955500   -0.035300  -17.109100
C       3.190700   -1.532500  -18.668000
H       3.296300   -2.630700  -18.757000
H       2.265700   -1.273500  -19.217300
C       4.397700   -0.836000  -19.312600
H       4.278500    0.262300  -19.238900
H       5.316800   -1.078400  -18.743900
C       4.580100   -1.238900  -20.782100
H       3.666000   -0.997800  -21.357600
H       4.704900   -2.335900  -20.861200
C       5.792100   -0.528400  -21.401800
H       5.662700    0.568500  -21.325000
H       6.704000   -0.765600  -20.819800
C       5.996200   -0.925000  -22.869900
H       5.086800   -0.690600  -23.455900
H       6.131100   -2.020500  -22.951400
C       7.207900   -0.205200  -23.479800
H       7.072400    0.891300  -23.401900
H       8.118300   -0.439600  -22.894100
C       7.422500   -0.594000  -24.940800
H       8.288200   -0.074400  -25.366300
H       6.553200   -0.340700  -25.558000
H       7.600000   -1.669800  -25.050800
C      -4.891700    5.195800    1.922500
C      -5.015800    4.562800    2.946000
C      -5.150500    3.822600    4.146900
C      -5.210300    2.418500    4.101100
C      -5.218300    4.494200    5.382300
C      -5.332600    1.685300    5.293500
H      -5.162100    1.900500    3.143200
C      -5.337200    3.749700    6.559900
H      -5.173900    5.587200    5.420000
C      -5.409600    0.270700    5.254100
C      -5.389300    2.353600    6.531900
C      -5.436000    4.482200    7.869800
C      -5.491000   -0.936600    5.230100
H      -5.474700    1.781300    7.457900
O      -6.426400    5.132200    8.196100
N      -4.308400    4.395100    8.660800
C      -5.614200   -2.349800    5.241300
H      -3.571200    3.685200    8.472700
C      -4.218700    5.090600    9.968500
C      -5.903500   -3.011500    6.446300
C      -5.470900   -3.098100    4.059300
C      -2.740700    5.052700   10.378100
C      -6.028800   -4.410100    6.424000
H      -6.039600   -2.456200    7.371200
C      -5.635800   -4.496400    4.121000
H      -5.232600   -2.601200    3.122500
O      -1.772100    4.841500    9.685400
O      -2.610100    5.326900   11.718200
N      -5.888400   -5.143700    5.294100
H      -6.270900   -4.977100    7.333600
C      -5.556000   -5.331200    2.884700
C      -1.250500    5.191300   12.262800
N      -5.159200   -6.627600    3.031500
C      -5.872400   -4.784300    1.625600
H      -0.575200    5.827700   11.666000
H      -0.963000    4.125900   12.140800
C      -1.377800    5.632000   13.715600
C      -5.032500   -7.397100    1.924200
C      -5.738800   -5.596400    0.484700
H      -6.222400   -3.759900    1.529200
H      -1.593400    6.717700   13.763700
H      -2.254700    5.140100   14.183900
C      -0.093700    5.294900   14.483100
C      -5.308100   -6.925100    0.630200
H      -4.678500   -8.423300    2.094300
C      -6.017700   -5.081500   -0.807300
H       0.789400    5.657200   13.919500
H       0.021500    4.194600   14.552400
C      -0.083900    5.906100   15.891300
H      -5.184300   -7.571600   -0.236100
C      -6.238000   -4.661600   -1.920800
H      -0.172500    7.007700   15.827300
H      -0.968400    5.565400   16.462700
C       1.202800    5.524700   16.636500
C      -6.486400   -4.167900   -3.225500
H       2.084800    5.809700   16.029200
H       1.256500    4.424200   16.748100
C       1.295400    6.189300   18.016900
C      -6.735900   -2.797700   -3.418500
C      -6.477500   -5.047400   -4.324600
H       1.247700    7.290100   17.911600
H       0.421600    5.907800   18.634600
C       2.594600    5.786700   18.729300
C      -6.972200   -2.306000   -4.713300
H      -6.746900   -2.118800   -2.565500
C      -6.711200   -4.541600   -5.607200
H      -6.285100   -6.114800   -4.176800
H       2.629000    4.686600   18.849900
H       3.464700    6.047900   18.095700
C       2.734600    6.462000   20.100300
C      -7.240500   -0.929000   -4.914400
C      -6.953300   -3.181400   -5.816300
C      -6.723900   -5.496500   -6.769100
H       1.869100    6.204000   20.740000
H       2.706400    7.562400   19.984800
C       4.040300    6.042000   20.790400
C      -7.484700    0.242200   -5.096300
H      -7.127400   -2.795500   -6.822800
O      -7.622000   -6.315700   -6.948200
N      -5.624100   -5.403300   -7.597700
H       4.064500    4.941300   20.908500
H       4.903700    6.294700   20.144800
C       4.203200    6.714500   22.159900
C      -7.796600    1.603200   -5.347700
H      -4.986000   -4.582500   -7.556500
C      -5.453900   -6.297200   -8.770000
H       3.342000    6.466100   22.809200
H       4.185000    7.815300   22.046000
C       5.510200    6.283800   22.841400
C      -8.171000    2.001500   -6.641700
C      -7.754300    2.558000   -4.316100
C      -3.998900   -6.136600   -9.229500
H       5.528100    5.182500   22.958300
H       6.372600    6.532700   22.192300
C       5.685200    6.948200   24.205100
C      -8.478600    3.354500   -6.858400
H      -8.232800    1.280600   -7.453400
C      -8.101600    3.890900   -4.614300
H      -7.453300    2.266500   -3.313100
O      -3.060000   -5.684500   -8.616100
O      -3.847500   -6.616700  -10.508200
H       6.619800    6.632500   24.682200
H       4.866400    6.692800   24.887200
H       5.712900    8.040600   24.121600
N      -8.435400    4.285900   -5.875900
H      -8.792100    3.718100   -7.846700
C      -8.131800    4.931000   -3.542000
C      -2.524800   -6.400800  -11.113900
N      -7.924000    6.224300   -3.921000
C      -8.356600    4.573000   -2.198100
H      -1.763300   -6.831000  -10.441100
H      -2.381400   -5.302000  -11.184700
C      -2.608300   -7.099400  -12.465400
C      -7.894600    7.184300   -2.965900
C      -8.326400    5.581300   -1.217500
H      -8.559400    3.543000   -1.916600
H      -2.672700   -8.195900  -12.320700
H      -3.550700   -6.817700  -12.978300
C      -1.393000   -6.731700  -13.325300
C      -8.087200    6.910600   -1.601700
H      -7.689700    8.204000   -3.320500
H      -0.461300   -6.865700  -12.739800
H      -1.433700   -5.655500  -13.587800
C      -1.314100   -7.574200  -14.606100
H      -8.045500    7.708300   -0.862900
H      -1.247500   -8.649100  -14.349400
H      -2.244100   -7.462400  -15.195700
C      -0.101600   -7.159500  -15.451300
H       0.818000   -7.209700  -14.835500
H      -0.204100   -6.099300  -15.754500
C       0.068000   -8.039200  -16.697700
H       0.176000   -9.100300  -16.401100
H      -0.843100   -7.992900  -17.323700
C       1.290400   -7.596400  -17.514500
H       1.169400   -6.540500  -17.825200
H       2.195300   -7.621100  -16.876400
C       1.508200   -8.477700  -18.751800
H       0.608400   -8.456400  -19.395800
H       1.635000   -9.534100  -18.446500
C       2.734600   -8.013000  -19.549800
H       2.603900   -6.957400  -19.857100
H       3.632000   -8.029000  -18.901200
C       2.974200   -8.887800  -20.787500
H       2.079600   -8.876300  -21.438900
H       3.110900   -9.943600  -20.484500
C       4.200800   -8.411200  -21.579200
H       4.064000   -7.355500  -21.884800
H       5.096600   -8.423500  -20.927700
C       4.451000   -9.275300  -22.813000
H       5.327200   -8.925300  -23.370400
H       3.596900   -9.256400  -23.499500
H       4.631000  -10.322100  -22.543300
C      -8.517500    5.265800    0.152400
C      -8.665400    5.022000    1.328300
C      -8.830700    4.738100    2.706900
C      -8.898900    3.403200    3.143400
C      -8.923000    5.792200    3.635400
C      -9.054500    3.123000    4.511600
H      -8.832100    2.588500    2.422500
C      -9.076300    5.496200    4.993500
H      -8.870800    6.831900    3.297600
C      -9.142700    1.780000    4.956500
C      -9.136700    4.175000    5.444100
C      -9.208300    6.634300    5.968600
C      -9.236600    0.637200    5.343400
H      -9.248400    3.954600    6.507700
O     -10.207300    7.346500    6.025100
N      -8.100100    6.834900    6.766700
C      -9.378000   -0.686900    5.833000
H      -7.355800    6.112300    6.847000
C      -8.039900    7.938500    7.756800
C      -9.734900   -0.894800    7.175900
C      -9.187400   -1.795700    4.989400
C      -6.570200    8.060200    8.182000
C      -9.878200   -2.215800    7.629600
H      -9.907600   -0.055400    7.845100
C      -9.377200   -3.087900    5.519400
H      -8.894400   -1.651300    3.952700
O      -5.584600    7.646200    7.617200
O      -6.470600    8.766100    9.357100
N      -9.696200   -3.293200    6.828700
H     -10.169400   -2.436200    8.665900
C      -9.254400   -4.296800    4.650300
C      -5.122400    8.845600    9.939200
N      -8.863500   -5.458400    5.248100
C      -9.528600   -4.220200    3.271100
H      -4.440200    9.254400    9.174500
H      -4.821200    7.807100   10.189800
C      -5.288100    9.749100   11.155300
C      -8.702100   -6.561600    4.478400
C      -9.359800   -5.375100    2.485100
H      -9.873500   -3.295300    2.816300
H      -5.507000   10.785200   10.829200
H      -6.176600    9.434300   11.740300
C      -4.024900    9.704800   12.023600
C      -8.936400   -6.567700    3.093400
H      -8.354800   -7.462600    5.002500
C      -9.597800   -5.338200    1.087400
H      -3.126500    9.854200   11.391800
H      -3.915700    8.696700   12.472000
C      -4.047900   10.765200   13.133700
H      -8.787300   -7.472700    2.507800
C      -9.784300   -5.325900   -0.108100
H      -4.129300   11.776300   12.690300
H      -4.948400   10.639500   13.764700
C      -2.782300   10.670700   13.997800
C      -9.995200   -5.306700   -1.509200
H      -1.884000   10.728600   13.352000
H      -2.738700    9.678300   14.487100
C      -2.719700   11.774900   15.062300
C     -10.237600   -4.084900   -2.161600
C      -9.958500   -6.506400   -2.244200
H      -2.759500   12.770000   14.579300
H      -3.609400   11.722600   15.718100
C      -1.439800   11.650400   15.901400
C     -10.439300   -4.063300   -3.551900
H     -10.269700   -3.157400   -1.589800
C     -10.158300   -6.467500   -3.627800
H      -9.771000   -7.458900   -1.738400
H      -1.412100   10.660200   16.396000
H      -0.553500   11.680700   15.237700
C      -1.330900   12.759000   16.957100
C     -10.704700   -2.837500   -4.211500
C     -10.392700   -5.260900   -4.291900
C     -10.145500   -7.763300   -4.392300
H      -2.212400   12.733900   17.625800
H      -1.352300   13.751400   16.467500
C      -0.044100   12.610100   17.781400
C     -10.950400   -1.796700   -4.779200
H     -10.541400   -5.240800   -5.373500
O     -11.037900   -8.601100   -4.292700
N      -9.029200   -7.948400   -5.183200
H      -0.025700   11.617300   18.271200
H       0.835700   12.630500   17.109300
C       0.086100   13.713400   18.839700
C     -11.272400   -0.607300   -5.481700
H      -8.392700   -7.157700   -5.410900
C      -8.825900   -9.189800   -5.970100
H      -0.791800   13.697900   19.513500
H       0.073300   14.707900   18.353900
C       1.374400   13.551500   19.659700
C     -11.653800   -0.685700   -6.831900
C     -11.240300    0.645800   -4.844300
C      -7.357900   -9.186000   -6.416900
H       1.387200   12.557100   20.147600
H       2.253400   13.568600   18.985900
C       1.515900   14.644400   20.716800
C     -11.989300    0.503100   -7.498600
H     -11.701300   -1.643500   -7.345000
C     -11.613600    1.787900   -5.581100
H     -10.927400    0.724600   -3.806400
O      -6.433500   -8.549900   -5.964600
O      -7.172400  -10.070800   -7.452500
H       2.437500   14.517800   21.295900
H       0.679500   14.632600   21.424700
H       1.547700   15.642100   20.264500
N     -11.966600    1.716400   -6.895900
H     -12.312500    0.498400   -8.548900
C     -11.652000    3.136600   -4.939300
C      -5.831500  -10.070000   -8.056900
N     -11.420300    4.213000   -5.744000
C     -11.906800    3.274000   -3.560900
H      -5.091900  -10.242300   -7.256400
H      -5.679300   -9.060700   -8.493600
C      -5.881900  -11.187900   -9.091400
C     -11.398500    5.447200   -5.186500
C     -11.886100    4.563100   -2.996400
H     -12.125200    2.408800   -2.940500
H      -5.948500  -12.170100   -8.583200
H      -6.812600  -11.106000   -9.689600
C      -4.647700  -11.125400   -9.999700
C     -11.623300    5.671000   -3.818100
H     -11.173000    6.276300   -5.871500
H      -3.729800  -11.039100   -9.384300
H      -4.685500  -10.205800  -10.617600
C      -4.535700  -12.356600  -10.910000
H     -11.585800    6.677200   -3.406000
H      -4.471600  -13.276400  -10.297200
H      -5.452100  -12.465400  -11.521300
C      -3.305300  -12.245900  -11.821600
H      -2.400300  -12.069600  -11.207600
H      -3.404500  -11.357200  -12.474900
C      -3.103300  -13.500400  -12.683000
H      -3.000600  -14.392300  -12.035600
H      -3.999200  -13.682600  -13.306500
C      -1.862400  -13.355000  -13.575500
H      -1.977000  -12.472000  -14.233700
H      -0.972900  -13.149800  -12.948100
C      -1.613800  -14.606700  -14.428000
H      -2.498100  -14.817300  -15.059200
H      -1.492500  -15.491800  -13.774600
C      -0.369300  -14.434200  -15.310900
H      -0.493600  -13.549400  -15.964800
H       0.512400  -14.218800  -14.676900
C      -0.100200  -15.678600  -16.167000
H      -0.979500  -15.899600  -16.801600
H       0.030900  -16.564700  -15.517000
C       1.143700  -15.491900  -17.048300
H       1.012900  -14.606400  -17.700500
H       2.024500  -15.272000  -16.413500
C       1.423200  -16.724400  -17.905300
H       2.311900  -16.578500  -18.529700
H       0.585100  -16.949800  -18.574700
H       1.597900  -17.613700  -17.289200
C     -12.112300    4.750900   -1.608400
C     -12.291900    4.935800   -0.426100
C     -12.496500    5.129000    0.963200
C     -12.579000    4.008200    1.809200
C     -12.615800    6.427400    1.494400
C     -12.778100    4.187200    3.188000
H     -12.491300    3.003500    1.395200
C     -12.807600    6.587200    2.870600
H     -12.556900    7.302800    0.839500
C     -12.900600    3.065100    4.044700
C     -12.883800    5.484500    3.724800
C     -12.963300    7.973500    3.434800
C     -13.039500    2.119100    4.786100
H     -13.026600    5.622200    4.798700
O     -14.002700    8.621600    3.333400
N     -11.832400    8.462800    4.056100
C     -13.261100    1.041000    5.680100
H     -11.058100    7.829300    4.337500
C     -11.782200    9.836200    4.616900
C     -13.771900    1.304300    6.963200
C     -13.014000   -0.287600    5.294400
C     -10.322400   10.094300    5.009500
C     -14.031700    0.218300    7.812100
H     -13.976300    2.323000    7.285000
C     -13.319000   -1.320300    6.203900
H     -12.593100   -0.508000    4.316600
O      -9.329900    9.501600    4.653800
O     -10.242100   11.173000    5.856900
N     -13.815500   -1.070200    7.447700
H     -14.452200    0.366000    8.816600
C     -13.116900   -2.749800    5.821900
C      -8.907200   11.454300    6.405400
N     -12.675700   -3.594200    6.796300
C     -13.355100   -3.180300    4.502600
H      -8.207800   11.582900    5.561600
H      -8.611800   10.566100    7.002500
C      -9.102000   12.717500    7.235400
C     -12.426500   -4.885300    6.467400
C     -13.092600   -4.523900    4.176400
H     -13.741600   -2.497700    3.750200
H      -9.323000   13.576000    6.570600
H      -9.999000   12.610100    7.879300
C      -7.855300   12.990700    8.085000
C     -12.617300   -5.393300    5.171700
H     -12.039600   -5.518500    7.278100
C     -13.285000   -4.996800    2.852600
H      -6.947600   12.942200    7.450500
H      -7.737900   12.191000    8.843600
C      -7.918600   14.358300    8.779400
H     -12.392600   -6.433700    4.944900
C     -13.429900   -5.414200    1.725900
H      -8.004500   15.163200    8.024100
H      -8.831400   14.430200    9.401200
C      -6.672000   14.582100    9.646900
C     -13.596200   -5.882600    0.398300
H      -5.760000   14.439200    9.034200
H      -6.626600   13.810400   10.439900
C      -6.648000   15.979000   10.282800
C     -13.832200   -4.957700   -0.635200
C     -13.525400   -7.259800    0.113800
H      -6.686600   16.754900    9.494300
H      -7.553200   16.132000   10.900700
C      -5.388200   16.164600   11.140600
C     -13.994700   -5.411200   -1.954500
H     -13.891700   -3.892100   -0.412100
C     -13.683700   -7.693200   -1.206500
H     -13.345500   -7.984200    0.915200
H      -5.365900   15.400300   11.941300
H      -4.486200   15.981900   10.524200
C      -5.312700   17.566100   11.761100
C     -14.270400   -4.498600   -3.002500
C     -13.911200   -6.786500   -2.244700
C     -13.636500   -9.165600   -1.509700
H      -6.210700   17.756100   12.379400
H      -5.327800   18.334200   10.964200
C      -4.046100   17.722600   12.614700
C     -14.538400   -3.746500   -3.911600
H     -14.026300   -7.136100   -3.272900
O     -14.558100   -9.932400   -1.239200
N     -12.461600   -9.585300   -2.100100
H      -4.035900   16.956400   13.413800
H      -3.150000   17.523500   11.995200
C      -3.946100   19.121900   13.235900
C     -14.907900   -2.902700   -4.989900
H     -11.799600   -8.904900   -2.523300
C     -12.220600  -11.012700   -2.426000
H      -4.840800   19.327000   13.854200
H      -3.949200   19.890900   12.439900
C      -2.678600   19.263700   14.091200
C     -15.404800   -3.472100   -6.175200
C     -14.821000   -1.504600   -4.879800
C     -10.746500  -11.127000   -2.831700
H      -2.676100   18.496000   14.889700
H      -1.782800   19.058900   13.472600
C      -2.566200   20.653400   14.714000
C     -15.812500   -2.613300   -7.207400
H     -15.488400   -4.551000   -6.284600
C     -15.270600   -0.715700   -5.957700
H     -14.412800   -1.047800   -3.981500
O      -9.843200  -10.349800   -2.625200
O     -10.527800  -12.314600   -3.487600
H      -1.659400   20.742100   15.322800
H      -3.420300   20.875300   15.363600
H      -2.524900   21.436700   13.948700
N     -15.751800   -1.261700   -7.108800
H     -16.231100   -3.005000   -8.144900
C     -15.251400    0.773700   -5.858300
C      -9.174100  -12.502900   -4.029600
N     -14.961700    1.474300   -6.990600
C     -15.503800    1.404700   -4.624900
H      -8.451500  -12.374300   -3.205300
H      -9.018900  -11.707900   -4.788800
C      -9.196100  -13.913200   -4.606600
C     -14.882800    2.825600   -6.910100
C     -15.414900    2.806400   -4.557200
H     -15.766900    0.827600   -3.742000
H      -9.264800  -14.655400   -3.786700
H     -10.116300  -14.059600   -5.208900
C      -7.945800  -14.155600   -5.460100
C     -15.097700    3.533600   -5.716300
H     -14.614700    3.345200   -7.840300
H      -7.039900  -13.852500   -4.897900
H      -7.975700  -13.507100   -6.358800
C      -7.813800  -15.624800   -5.885100
H     -15.008000    4.617500   -5.689800
H      -7.759500  -16.274900   -4.990600
H      -8.717700  -15.946400   -6.436700
C      -6.565900  -15.824400   -6.756500
H      -5.673200  -15.441800   -6.223400
H      -6.652400  -15.214400   -7.676700
C      -6.347300  -17.296800   -7.130800
H      -6.258900  -17.911900   -6.214800
H      -7.230100  -17.687500   -7.671600
C      -5.087900  -17.457200   -7.994100
H      -5.188900  -16.854800   -8.917600
H      -4.212100  -17.042200   -7.457800
C      -4.821300  -18.923600   -8.359300
H      -5.691200  -19.344100   -8.898900
H      -4.716200  -19.529700   -7.439100
C      -3.556800  -19.055000   -9.220000
H      -3.666100  -18.450700  -10.141300
H      -2.689700  -18.626600   -8.680000
C      -3.267600  -20.516000   -9.588500
H      -4.131600  -20.949100  -10.127700
H      -3.152900  -21.122600   -8.669900
C      -2.002900  -20.634100  -10.451400
H      -2.117800  -20.028700  -11.371800
H      -1.137700  -20.201500   -9.911500
C      -1.703200  -22.084300  -10.824100
H      -0.800300  -22.156200  -11.440400
H      -2.525200  -22.533100  -11.393200
H      -1.543600  -22.704800   -9.935100
C     -15.628000    3.484300   -3.330400
C     -15.796800    4.082200   -2.292000
C     -16.002800    4.806800   -1.092400
C     -16.249700    4.131600    0.114500
C     -15.976100    6.213400   -1.121500
C     -16.481300    4.868100    1.289900
H     -16.273100    3.041800    0.137600
C     -16.186100    6.934700    0.059000
H     -15.806300    6.744300   -2.062900
C     -16.801100    4.180400    2.487700
C     -16.441200    6.275300    1.265600
C     -16.169800    8.435500   -0.040400
C     -17.119900    3.576400    3.486700
H     -16.618500    6.838600    2.184600
O     -16.732000    9.052100   -0.933000
N     -15.427200    9.080100    0.939800
C     -17.568900    2.862700    4.627200
H     -14.975200    8.575500    1.724600
C     -15.337700   10.555500    0.978900
C     -18.456500    3.472900    5.532600
C     -17.182900    1.528800    4.839600
C     -13.890200   10.917200    1.338600
C     -18.959400    2.706100    6.593400
H     -18.752700    4.511400    5.405400
C     -17.739500    0.833600    5.932000
H     -16.470000    1.044200    4.175500
O     -12.891000   10.239000    1.279000
O     -13.832800   12.225000    1.761500
N     -18.629300    1.404000    6.789400
H     -19.661900    3.132600    7.320900
C     -17.367000   -0.592600    6.169100
C     -12.525000   12.690800    2.239200
N     -16.920900   -0.919400    7.413300
C     -17.449300   -1.524800    5.118600
H     -11.780900   12.508200    1.445200
H     -12.274900   12.080300    3.132300
C     -12.740900   14.168600    2.543100
C     -16.537500   -2.202600    7.637600
C     -17.038800   -2.847300    5.366300
H     -17.826800   -1.235300    4.141200
H     -12.909900   14.725400    1.599900
H     -13.673900   14.300500    3.128200
C     -11.537300   14.734900    3.305200
C     -16.577700   -3.196300    6.646200
H     -16.160700   -2.421700    8.646500
C     -17.075900   -3.816800    4.332200
H     -10.598300   14.462300    2.783100
H     -11.474900   14.264800    4.307000
C     -11.613400   16.261100    3.452300
H     -16.244500   -4.209400    6.864300
C     -17.098400   -4.652800    3.457400
H     -11.655900   16.736200    2.453100
H     -12.551800   16.550200    3.962800
C     -10.402900   16.789100    4.234800
C     -17.141500   -5.636700    2.439200
H      -9.467500   16.441700    3.753300
H     -10.398400   16.353400    5.252700
C     -10.392600   18.321100    4.328000
C     -17.475700   -5.272000    1.124000
C     -16.873100   -6.982100    2.751900
H     -10.399900   18.762800    3.313100
H     -11.317600   18.679100    4.818600
C      -9.161300   18.809800    5.104100
C     -17.554900   -6.259000    0.125900
H     -17.685600   -4.229700    0.881400
C     -16.934100   -7.952300    1.744900
H     -16.633000   -7.274800    3.778400
H      -9.167000   18.378300    6.123700
H      -8.240300   18.429100    4.620700
C      -9.102300   20.340800    5.190600
C     -17.963800   -5.892900   -1.180900
C     -17.276500   -7.603900    0.434400
C     -16.669800   -9.379300    2.140000
H     -10.017500   20.728600    5.677300
H      -9.094000   20.777300    4.173500
C      -7.860100   20.800100    5.967400
C     -18.361200   -5.566000   -2.276300
H     -17.340800   -8.362800   -0.348800
O     -17.108800   -9.882000    3.163300
N     -15.852500  -10.089100    1.269200
H      -7.871000   20.362200    6.984200
H      -6.947100   20.406700    5.479700
C      -7.779400   22.329400    6.061600
C     -18.898400   -5.176700   -3.529500
H     -15.499900   -9.690500    0.380300
C     -15.551200  -11.517600    1.503700
H      -8.690400   22.727900    6.547500
H      -7.763300   22.771000    5.046900
C      -6.534800   22.775200    6.843100
C     -19.626400   -6.099400   -4.303200
C     -18.760800   -3.856200   -3.987600
C     -14.078800  -11.741500    1.132700
H      -6.550700   22.333900    7.858800
H      -5.622900   22.378200    6.355500
C      -6.442600   24.296100    6.944800
C     -20.223800   -5.650500   -5.489500
H     -19.731000   -7.132900   -3.981700
C     -19.398900   -3.491900   -5.190100
H     -18.175400   -3.130500   -3.426600
O     -13.179400  -10.938600    1.041900
O     -13.856700  -13.081200    0.913100
H      -5.551800   24.601900    7.504700
H      -7.313700   24.720100    7.456900
H      -6.384700   24.764100    5.955500
N     -20.134100   -4.368200   -5.927200
H     -20.809000   -6.328700   -6.123400
C     -19.298500   -2.085800   -5.680000
C     -12.512700  -13.446900    0.450200
N     -18.799800   -1.897300   -6.932200
C     -19.678300   -1.019000   -4.842400
H     -11.776500  -13.041200    1.165100
H     -12.374000  -12.965600   -0.541400
C     -12.537600  -14.970200    0.398300
C     -18.662300   -0.621700   -7.377100
C     -19.529000    0.286600   -5.319500
H     -20.082200   -1.208400   -3.851500
H     -12.620100  -15.379100    1.425300
H     -13.453200  -15.314200   -0.124800
C     -11.281000  -15.499300   -0.302100
C     -19.013900    0.496500   -6.600200
H     -18.231200   -0.508100   -8.381300
H     -19.808700    1.133500   -4.692800
H     -10.379000  -15.021600    0.130400
H     -11.297200  -15.205500   -1.370700
C     -11.154200  -17.025000   -0.185400
H     -18.874500    1.501400   -6.991700
H     -11.123500  -17.322000    0.880800
H     -12.050200  -17.517200   -0.608900
C      -9.891100  -17.518100   -0.905100
H      -9.006800  -16.971000   -0.522400
H      -9.956000  -17.271000   -1.982600
C      -9.672600  -19.027400   -0.732600
H      -9.609600  -19.280900    0.343000
H     -10.544400  -19.586100   -1.122700
C      -8.393300  -19.476400   -1.453200
H      -8.468400  -19.236300   -2.531500
H      -7.528900  -18.896400   -1.074700
C      -8.124700  -20.976700   -1.274800
H      -8.983000  -21.563300   -1.654400
H      -8.045200  -21.221800   -0.198300
C      -6.839600  -21.395000   -2.003400
H      -6.922500  -21.149300   -3.079800
H      -5.984600  -20.802100   -1.624100
C      -6.548100  -22.891700   -1.833600
H      -7.400500  -23.489000   -2.209900
H      -6.459000  -23.140600   -0.758800
C      -5.262900  -23.296800   -2.570000
H      -5.351700  -23.048200   -3.645700
H      -4.409400  -22.700400   -2.191800
C      -4.961100  -24.785100   -2.409600
H      -4.043100  -25.062100   -2.939800
H      -5.770700  -25.406600   -2.808400
H      -4.826900  -25.058500   -1.356800
C     -16.470000  -12.412300    0.673600
H     -17.513200  -12.308500    1.000500
H     -16.429700  -12.161300   -0.395100
H     -16.187200  -13.469700    0.773400
C     -13.143000  -11.507800   -3.535400
H     -13.061400  -10.891400   -4.440900
H     -12.908400  -12.542400   -3.817400
H     -14.192800  -11.470300   -3.204200
C      -9.770600   -9.263400   -7.165600
H      -9.684000   -8.377400   -7.809800
H      -9.560000  -10.143400   -7.787700
H     -10.815800   -9.324100   -6.826200
C      -6.432000   -5.954200   -9.889700
H      -6.353600   -4.900800  -10.192900
H      -6.249300   -6.567200  -10.782200
H      -7.468200   -6.126500   -9.560600
C      -3.131900   -1.924900  -11.399200
H      -3.055700   -0.831000  -11.327800
H      -2.974000   -2.197300  -12.451100
H      -4.160400   -2.202800  -11.122400
C       0.156000    2.402600  -11.524100
H       0.244700    3.405100  -11.083000
H       0.285200    2.508600  -12.609400
H      -0.868200    2.047600  -11.332800
C       3.481900    6.502900  -10.241400
H       3.581500    7.294100   -9.485600
H       3.586400    6.974600  -11.227500
H       2.461500    6.097400  -10.161400
C       6.840400    9.931100   -7.718100
H       6.934500   10.420000   -6.738800
H       6.931900   10.708900   -8.487700
H       5.823800    9.510600   -7.776700
C      10.103000   12.192700   -4.297600
H      10.114100   12.327100   -3.209100
H      10.150600   13.187800   -4.758900
H       9.125700   11.746600   -4.554100
C     -16.316300   11.135300    1.998400
H     -17.353800   10.949200    1.690300
H     -16.181400   10.691800    2.994300
H     -16.183200   12.221600    2.100300
C     -12.717400   10.000600    5.810500
H     -12.512600    9.260000    6.595700
H     -12.618400   10.996400    6.261500
H     -13.764700    9.866400    5.496300
C      -8.948000    7.674100    8.954200
H      -8.723600    6.711200    9.433600
H      -8.839300    8.454500    9.719000
H     -10.002100    7.647600    8.638200
C      -5.104500    4.432100   11.021700
H      -4.877400    3.363100   11.136700
H      -4.974100    4.903300   12.004900
H      -6.164800    4.515600   10.738400
C      -1.237600    0.680000   11.756200
H      -1.010500   -0.361400   11.488800
H      -1.083000    0.782500   12.838500
H      -2.304100    0.850200   11.543400
C       2.612700   -3.056200   11.086500
H       2.814800   -3.948400   10.477500
H       2.792300   -3.326500   12.135400
H       1.544800   -2.814300   10.972100
C       6.394100   -6.394100    9.087800
H       6.571500   -7.022000    8.203500
H       6.603300   -7.008700    9.973500
H       5.324700   -6.131900    9.096400
C      10.082300   -8.913100    5.957600
H      10.208000   -9.221800    4.910900
H      10.312200   -9.781800    6.588900
H       9.020000   -8.659900    6.098600
C      13.491000  -10.098400    2.140000
H      13.461800  -10.060400    1.044200
H      13.701100  -11.134900    2.435100
H      12.476600   -9.844200    2.495500
H     -15.677900  -11.750500    2.603700
H     -15.561700   10.971300   -0.049300
H     -12.379500  -11.634500   -1.485900
H      -8.990300  -10.087000   -5.291900
H      -5.608600   -7.373300   -8.438400
H      -2.280400   -3.749700  -10.538700
H       1.009800    0.392200  -11.366700
H       4.338100    4.566600  -10.802300
H       7.709700    8.309600   -8.906000
H      11.167200   11.178100   -5.917100
H     -12.066200   10.574500    3.798900
H      -8.345400    8.907800    7.247800
H      -4.525000    6.176300    9.830600
H      -0.680400    2.732100   11.230300
H       3.192900   -0.952100   11.268600
H       6.987100   -4.474400    9.960000
H      10.759300   -7.396400    7.382700
H      14.486100   -9.199400    3.866500

1460
poly(1-2) s-cis 18-mer right-handed PM7 optimized
N     -11.962800   -2.772800   -6.042400
C     -11.780700   -3.985500   -5.461800
C     -11.939000   -4.202100   -4.082800
C     -12.308500   -3.114700   -3.273500
C     -12.500700   -1.851400   -3.858700
C     -12.306000   -1.722500   -5.246700
N     -13.136000   -0.304900   -7.057400
C     -13.236500    0.904900   -7.662600
C     -12.688700    2.079500   -7.124600
C     -12.000300    1.997000   -5.901500
C     -11.842400    0.742500   -5.287000
C     -12.432700   -0.384600   -5.895000
H     -11.471000   -4.798800   -6.134600
H     -11.766600   -5.186900   -3.653600
H     -12.801800   -1.001400   -3.251500
H     -13.789000    0.916100   -8.611500
H     -12.802800    3.032000   -7.637000
H     -11.278800    0.645600   -4.361300
C     -12.490000   -3.295400   -1.879100
C     -12.661100   -3.473000   -0.694500
C     -12.904000   -3.762000    0.670300
C     -13.019000   -2.744400    1.631000
C     -13.068800   -5.109400    1.044400
C     -13.311500   -3.075100    2.967000
H     -12.889200   -1.700700    1.341800
C     -13.367000   -5.419000    2.372100
H     -12.967800   -5.900000    0.298200
C     -13.487700   -4.419800    3.342700
C     -13.447200   -2.042700    3.932100
C     -13.553600   -6.858600    2.756600
H     -13.724800   -4.676400    4.379300
C     -13.570600   -1.158200    4.743100
O     -12.718200   -7.502300    3.375000
N     -14.746600   -7.411700    2.300300
H     -13.677200   -0.399100    5.438200
H     -15.452900   -6.835900    1.832600
C     -15.183100   -8.750900    2.758000
H     -14.324700   -9.473900    2.641600
C     -15.656000   -8.719500    4.209800
C     -16.366100   -9.214000    1.901400
H     -16.321300   -9.560400    4.444000
H     -14.781300   -8.774500    4.883800
H     -16.176900   -7.790400    4.472400
O     -17.019200   -8.594000    1.098800
O     -16.632700  -10.508900    2.254200
C     -17.870000  -11.116100    1.750300
H     -18.695600  -10.402500    1.916900
H     -17.736300  -11.291900    0.670700
C     -17.996000  -12.395400    2.573000
H     -17.929400  -12.162400    3.654500
H     -17.136700  -13.064600    2.366800
C     -19.323000  -13.085000    2.245100
H     -20.167100  -12.444300    2.570900
H     -19.426700  -13.187300    1.145200
C     -19.452800  -14.470100    2.894400
H     -19.445800  -14.383900    3.997100
H     -18.582700  -15.102100    2.635800
C     -20.752400  -15.131800    2.416400
H     -21.616300  -14.502400    2.708800
H     -20.761500  -15.160200    1.307700
C     -20.953100  -16.552600    2.958400
H     -21.009100  -16.539700    4.062700
H     -20.085100  -17.190500    2.707000
C     -22.238000  -17.148300    2.365400
H     -22.171600  -17.142300    1.259000
H     -23.098900  -16.498100    2.618200
C     -22.514400  -18.575500    2.852700
H     -21.662200  -19.236000    2.604000
H     -22.598400  -18.592700    3.955600
C     -23.803500  -19.114500    2.215900
H     -23.711400  -19.093800    1.112200
H     -24.649400  -18.442500    2.459900
C     -24.124800  -20.539900    2.680300
H     -23.285800  -21.217600    2.432600
H     -24.218600  -20.568500    3.782500
C     -25.419000  -21.053200    2.032100
H     -25.322800  -21.026200    0.928800
H     -26.259000  -20.374100    2.278000
C     -25.755000  -22.472100    2.484000
H     -26.679300  -22.827600    2.015100
H     -24.960100  -23.178600    2.219400
H     -25.894900  -22.528100    3.569500
C     -11.526700    3.172000   -5.262200
C     -11.186900    4.179800   -4.683900
C     -10.846500    5.344000   -3.949200
C     -10.586100    5.224000   -2.570100
C     -10.824000    6.608700   -4.567500
C     -10.321800    6.372000   -1.807800
H     -10.602600    4.242000   -2.095300
C     -10.555200    7.740600   -3.791800
H     -11.024300    6.702400   -5.638300
C     -10.117800    6.307300   -0.408300
C     -10.299500    7.638400   -2.423100
C     -10.518200    9.105100   -4.419300
C      -9.975300    6.329900    0.792800
H     -10.088400    8.529600   -1.828100
O      -9.581900    9.502900   -5.098700
N     -11.610700    9.907200   -4.104400
C      -9.824300    6.383600    2.201500
H     -12.412000    9.537300   -3.585800
C     -11.796100   11.220500   -4.765600
C      -9.293300    7.531900    2.811100
C     -10.211800    5.292600    2.998400
H     -10.830700   11.801400   -4.695700
C     -12.208600   11.059700   -6.226900
C     -12.907400   11.996000   -4.050700
C      -9.177100    7.551000    4.211400
H      -8.969800    8.384200    2.216800
C     -10.046000    5.392800    4.392800
H     -10.636700    4.400500    2.545500
H     -12.783700   11.918800   -6.594400
H     -11.303500   10.962700   -6.854200
H     -12.796900   10.151300   -6.409600
O     -13.675500   11.622500   -3.198700
O     -12.937900   13.247600   -4.602700
N      -9.548700    6.507700    4.995100
H      -8.748800    8.417600    4.736600
C     -10.381100    4.230800    5.267200
C     -14.054200   14.131800   -4.247500
N     -11.072900    4.475900    6.413900
C      -9.990900    2.932700    4.881700
H     -14.990100   13.550000   -4.312700
H     -13.889500   14.465900   -3.210500
C     -13.962200   15.254100   -5.278700
C     -11.358100    3.426400    7.225500
C     -10.343600    1.851200    5.707700
H      -9.427400    2.767700    3.965600
H     -13.930500   14.830200   -6.302100
H     -13.005300   15.800600   -5.160600
C     -15.158100   16.196900   -5.114600
C     -11.017300    2.102000    6.916200
H     -11.889100    3.677300    8.153000
H     -16.095500   15.652600   -5.345000
H     -15.239800   16.508600   -4.052700
C     -15.067000   17.448300   -6.000000
H     -11.272700    1.288200    7.591800
H     -15.069900   17.168100   -7.069900
H     -14.110200   17.976400   -5.828300
C     -16.245300   18.378500   -5.683600
H     -17.197000   17.848100   -5.883300
H     -16.249000   18.607800   -4.598200
C     -16.220200   19.693100   -6.474800
H     -16.272100   19.491400   -7.560800
H     -15.264600   20.225800   -6.311100
C     -17.400200   20.573300   -6.038500
H     -17.342100   20.754800   -4.946600
H     -18.350000   20.026500   -6.201600
C     -17.449600   21.916800   -6.775600
H     -16.506100   22.473300   -6.619700
H     -17.526700   21.752200   -7.866900
C     -18.641800   22.748400   -6.280500
H     -18.557200   22.907900   -5.187500
H     -19.580400   22.179200   -6.428500
C     -18.737000   24.102100   -6.994000
H     -17.803800   24.677100   -6.841800
H     -18.821600   23.950700   -8.086900
C     -19.938200   24.912100   -6.484500
H     -19.852200   25.063700   -5.390500
H     -20.871900   24.335800   -6.636600
C     -20.048900   26.264400   -7.184200
H     -20.908300   26.833200   -6.811700
H     -19.155000   26.877200   -7.021900
H     -20.175700   26.149300   -8.266500
C     -10.079600    0.521000    5.293400
C      -9.916300   -0.614400    4.907400
C      -9.768100   -1.928600    4.397400
C      -9.489000   -2.097000    3.027400
C      -9.928000   -3.050200    5.231600
C      -9.391100   -3.389800    2.492000
H      -9.352800   -1.226200    2.385500
C      -9.815700   -4.331300    4.679200
H     -10.136300   -2.920400    6.297200
C      -9.138900   -3.604400    1.116300
C      -9.556000   -4.515900    3.321400
C      -9.876500   -5.536300    5.573200
C      -8.941200   -3.857400   -0.049300
H      -9.472300   -5.521100    2.902300
O      -8.971000   -5.770800    6.370000
N     -10.980200   -6.354800    5.419200
C      -8.723800   -4.199500   -1.407100
H     -11.667600   -6.217800    4.661400
C     -11.218800   -7.516100    6.313600
C      -8.455700   -5.534000   -1.751900
C      -8.782100   -3.219000   -2.412600
H     -10.629300   -8.400200    5.939300
C     -10.862600   -7.194400    7.756900
C     -12.709200   -7.871000    6.325200
C      -8.276000   -5.844700   -3.109600
H      -8.378400   -6.306000   -0.989100
C      -8.569300   -3.613800   -3.747800
H      -8.997100   -2.185100   -2.155600
H     -11.231700   -7.964100    8.451300
H      -9.767300   -7.123800    7.876700
H     -11.273200   -6.217200    8.070400
O     -13.665100   -7.244800    5.935900
O     -12.832200   -9.085300    6.963000
N      -8.345500   -4.913400   -4.091900
H      -8.046500   -6.869200   -3.435900
C      -8.573100   -2.603200   -4.847300
C     -14.190600   -9.618500    7.093300
N      -8.955200   -3.030600   -6.084400
C      -8.211200   -1.264900   -4.596800
H     -14.841200   -8.819900    7.490400
H     -14.504800   -9.885500    6.062400
C     -14.106600  -10.836300    8.005500
C      -9.015900   -2.127900   -7.092600
C      -8.286000   -0.336900   -5.651800
H      -7.871400   -0.950000   -3.613100
H     -14.014900  -10.527800    9.063900
H     -13.192100  -11.424200    7.788800
C     -15.373800  -11.673600    7.779200
C      -8.696100   -0.770700   -6.922700
H      -9.355200   -2.520400   -8.061600
C      -7.973000    1.029700   -5.429100
H     -16.266000  -11.015700    7.834500
H     -15.367600  -12.082000    6.748200
C     -15.552100  -12.826500    8.774800
H      -8.772200   -0.073900   -7.754700
C      -7.726900    2.200100   -5.243900
H     -15.574300  -12.443800    9.812300
H     -14.692000  -13.519900    8.727400
C     -16.858300  -13.565800    8.445800
C      -7.442100    3.563400   -4.977800
H     -17.703900  -12.849200    8.469200
H     -16.812400  -13.944300    7.404900
C     -17.157000  -14.731900    9.394900
C      -7.157900    3.950700   -3.654500
C      -7.440200    4.519200   -6.010500
H     -17.220400  -14.371400   10.438800
H     -16.326200  -15.462300    9.377100
C     -18.471500  -15.418400    8.992700
C      -6.884600    5.297600   -3.364600
H      -7.144900    3.207600   -2.857500
C      -7.155500    5.855100   -5.703700
H      -7.653200    4.218500   -7.040200
H     -18.404600  -15.768900    7.944100
H     -19.299500  -14.682900    9.010800
C     -18.811100  -16.599500    9.909900
C      -6.607100    5.721300   -2.044600
C      -6.883600    6.256900   -4.395600
C      -7.029600    6.865400   -6.808300
H     -17.987900  -17.339500    9.894300
H     -18.887700  -16.254900   10.958900
C     -20.124500  -17.271200    9.483600
C      -6.371300    6.136800   -0.933800
H      -6.659200    7.301500   -4.169500
O      -6.092600    6.810900   -7.602600
N      -7.996500    7.852700   -6.847100
H     -20.049200  -17.613100    8.433300
H     -20.949300  -16.533000    9.498900
C     -20.469000  -18.456000   10.394900
C      -6.101300    6.663200    0.355900
H      -8.705800    7.959100   -6.103500
C      -8.040100    8.860800   -7.937300
H     -19.646500  -19.196700   10.378200
H     -20.544700  -18.114700   11.445200
C     -21.782100  -19.130700    9.973300
C      -5.623900    7.976900    0.483600
C      -6.314200    5.884100    1.505100
H      -7.320200    9.694300   -7.700800
C      -7.726400    8.238000   -9.288600
C      -9.454900    9.435000   -8.066800
H     -21.707900  -19.478500    8.924400
H     -22.608000  -18.393000    9.989500
C     -22.124200  -20.308400   10.883400
C      -5.398000    8.476600    1.776900
H      -5.422000    8.589500   -0.392700
C      -6.041900    6.456100    2.763200
H      -6.689400    4.867600    1.416600
H      -7.968900    8.917200  -10.119600
H      -6.653400    7.985800   -9.355300
H      -8.277500    7.291700   -9.439800
O     -10.504000    9.035900   -7.621300
O      -9.376200   10.532500   -8.895900
H     -23.061800  -20.786400   10.578800
H     -21.342200  -21.076000   10.860000
H     -22.241100  -19.992200   11.926200
N      -5.615200    7.744100    2.895800
H      -5.008900    9.492500    1.937900
C      -6.210100    5.657100    4.014000
C     -10.631200   11.241000   -9.161300
N      -6.538500    6.341500    5.146300
C      -6.054100    4.257100    4.003600
H     -11.402300   10.497500   -9.427500
H     -10.895400   11.737500   -8.202900
C     -10.357700   12.246400  -10.273600
C      -6.750200    5.643200    6.287600
C      -6.286500    3.543800    5.194400
H      -5.751400    3.732100    3.101000
H     -10.313700   11.744800  -11.258000
H      -9.363400   12.716100  -10.134700
C     -11.477000   13.296300  -10.232700
C      -6.641900    4.244500    6.358100
H      -7.037000    6.240300    7.164300
H     -12.460900   12.783100  -10.201200
H     -11.401000   13.872300   -9.287400
C     -11.472100   14.274300  -11.413800
H      -6.836100    3.718000    7.290100
H     -11.552700   13.728000  -12.372000
H     -10.515100   14.826300  -11.459800
C     -12.647500   15.250900  -11.252200
H     -13.594500   14.678900  -11.180200
H     -12.547700   15.791400  -10.289600
C     -12.755700   16.265800  -12.395700
H     -12.869800   15.742000  -13.363500
H     -11.821600   16.853100  -12.477600
C     -13.949800   17.202400  -12.157500
H     -13.833400   17.715800  -11.183000
H     -14.880400   16.607400  -12.074900
C     -14.098500   18.242900  -13.273600
H     -13.171100   18.841200  -13.358700
H     -14.221400   17.735900  -14.249700
C     -15.295200   19.168300  -13.011200
H     -15.173600   19.673800  -12.033700
H     -16.222800   18.569700  -12.926400
C     -15.447700   20.213200  -14.123800
H     -14.519900   20.811100  -14.208800
H     -15.569800   19.708300  -15.101300
C     -16.642500   21.142500  -13.867600
H     -16.521700   21.652100  -12.891800
H     -17.572500   20.546600  -13.784200
C     -16.794100   22.182200  -14.975800
H     -17.645700   22.844600  -14.784600
H     -15.901300   22.811800  -15.063200
H     -16.957400   21.711100  -15.951700
C      -6.188500    2.127800    5.219600
C      -6.127200    0.919900    5.253800
C      -6.056800   -0.496600    5.246200
C      -5.836600   -1.158700    4.023400
C      -6.200000   -1.236500    6.434800
C      -5.776000   -2.560200    3.990600
H      -5.708400   -0.583900    3.106200
C      -6.125700   -2.633500    6.384300
H      -6.359800   -0.722400    7.386500
C      -5.560300   -3.250300    2.773400
C      -5.924400   -3.304400    5.176600
C      -6.133900   -3.428400    7.660800
C      -5.380700   -3.878800    1.755900
H      -5.868500   -4.394900    5.149500
O      -5.157500   -3.396300    8.411100
N      -7.260500   -4.186100    7.911900
C      -5.181000   -4.660800    0.590800
H      -8.007300   -4.302300    7.202200
C      -7.419700   -4.978200    9.160200
C      -4.934500   -6.037200    0.716500
C      -5.235000   -4.078000   -0.687700
H      -6.910000   -5.974700    9.031600
C      -6.871200   -4.235500   10.366700
C      -8.907800   -5.213500    9.458200
C      -4.767400   -6.791000   -0.456500
H      -4.867900   -6.506700    1.695700
C      -5.040500   -4.903700   -1.812600
H      -5.435100   -3.015400   -0.795000
H      -7.157000   -4.717700   11.313500
H      -5.769100   -4.185700   10.330700
H      -7.233000   -3.189600   10.382900
O      -9.890400   -4.668800    9.018000
O      -8.982400   -6.193600   10.428400
N      -4.836000   -6.246300   -1.695800
H      -4.551000   -7.868000   -0.419100
C      -5.050200   -4.327600   -3.191100
C     -10.325100   -6.658100   10.786700
N      -5.398100   -5.164500   -4.210500
C      -4.731300   -2.973400   -3.413300
H     -11.011200   -5.794100   10.797200
H     -10.606300   -7.368200    9.982900
C     -10.257100   -7.391300   12.122700
C      -5.480700   -4.661000   -5.464700
C      -4.817400   -2.464400   -4.722800
H      -4.414800   -2.329700   -2.596600
H     -10.227500   -6.685500   12.971500
H      -9.327000   -7.988200   12.195400
C     -11.503600   -8.289500   12.178300
C      -5.205300   -3.317300   -5.768600
H      -5.800600   -5.369500   -6.241300
C      -4.532900   -1.099200   -4.988600
H     -12.408000   -7.663400   12.028400
H     -11.478400   -8.997200   11.322300
C     -11.671400   -9.093200   13.471700
H      -5.297900   -2.948300   -6.787900
C      -4.304200    0.063800   -5.234000
H     -11.709700   -8.419500   14.347400
H     -10.801700   -9.756100   13.635800
C     -12.964300   -9.918900   13.368700
C      -4.032500    1.434300   -5.476300
H     -13.817600   -9.243200   13.157300
H     -12.897900  -10.601600   12.498000
C     -13.264400  -10.732900   14.631400
C      -3.718400    2.267800   -4.386100
C      -4.064300    1.961200   -6.781500
H     -13.317100  -10.065100   15.512100
H     -12.438000  -11.439500   14.836200
C     -14.587000  -11.498700   14.472000
C      -3.454300    3.629100   -4.601700
H      -3.673800    1.854900   -3.378200
C      -3.784000    3.318200   -6.979300
H      -4.297300    1.312900   -7.630400
H     -14.528800  -12.171300   13.594400
H     -15.407600  -10.788300   14.252000
C     -14.926300  -12.309800   15.727900
C      -3.133900    4.486600   -3.521900
C      -3.492000    4.160700   -5.905100
C      -3.658500    3.858500   -8.377400
H     -14.109700  -13.024800   15.945200
H     -14.980100  -11.637700   16.606200
C     -16.252600  -13.066600   15.570000
C      -2.851500    5.250000   -2.626700
H      -3.279900    5.219400   -6.070100
O      -2.703100    3.528800   -9.080100
N      -4.634900    4.741700   -8.794100
H     -16.200700  -13.743300   14.695400
H     -17.071200  -12.354000   15.352000
C     -16.580900  -13.870200   16.835100
C      -2.524800    6.180700   -1.608600
H      -5.358200    5.101200   -8.143300
C      -4.646300    5.322100  -10.163300
H     -15.760200  -14.580700   17.052700
H     -16.630400  -13.192800   17.709700
C     -17.905500  -14.635000   16.697200
C      -2.056500    7.456700   -1.961700
C      -2.669900    5.844700   -0.251400
H      -3.986800    6.235400  -10.180600
C      -4.204200    4.311500  -11.208200
C      -6.074300    5.729600  -10.553100
H     -17.856800  -15.318600   15.827800
H     -18.728600  -13.927200   16.481300
C     -18.222400  -15.429600   17.962300
C      -1.776900    8.368500   -0.931100
H      -1.903600    7.730400   -3.003400
C      -2.346700    6.812200    0.720500
H      -3.032600    4.860300    0.032100
H      -4.404300    4.662700  -12.231400
H      -3.122800    4.106100  -11.126300
H      -4.718200    3.342400  -11.062100
O      -7.134300    5.428600  -10.057800
O      -5.988900    6.525600  -11.678200
H     -19.168600  -15.974800   17.861700
H     -17.441900  -16.166300   18.181800
H     -18.312000  -14.776800   18.837400
N      -1.932800    8.066500    0.380100
H      -1.395400    9.376800   -1.147100
C      -2.447200    6.496800    2.177300
C      -7.240100    7.122200  -12.153800
N      -2.664400    7.545100    3.022600
C      -2.341300    5.171400    2.643200
H      -8.055100    6.388800  -12.030300
H      -7.405400    8.001300  -11.497900
C      -7.056000    7.587600  -13.594800
C      -2.827400    7.292000    4.342700
C      -2.510400    4.922800    4.018700
H      -2.124400    4.352500    1.962200
H      -7.135200    6.748000  -14.307800
H      -6.043400    8.011500  -13.741200
C      -8.145600    8.643700  -13.842200
C      -2.765100    5.997700    4.885300
H      -3.036200    8.167000    4.973600
H      -9.137200    8.202400  -13.606800
H      -8.007600    9.481900  -13.125900
C      -8.187700    9.218600  -15.261600
H      -2.918700    5.835600    5.950000
H      -8.332300    8.414300  -16.006100
H      -7.225400    9.700100  -15.516600
C      -9.336000   10.238100  -15.340000
H     -10.284000    9.750000  -15.036000
H      -9.163900   11.046500  -14.601700
C      -9.505300   10.850100  -16.734100
H      -9.662800   10.052000  -17.484200
H      -8.578400   11.372600  -17.037200
C     -10.690200   11.827900  -16.749000
H     -10.525500   12.629200  -16.002700
H     -11.612800   11.304000  -16.431000
C     -10.895800   12.445400  -18.137100
H      -9.977200   12.977600  -18.451400
H     -11.051600   11.644800  -18.885700
C     -12.088400   13.411800  -18.154500
H     -11.934700   14.216000  -17.409700
H     -13.009100   12.883200  -17.841200
C     -12.283000   14.019400  -19.549700
H     -11.360600   14.545500  -19.862800
H     -12.434600   13.212900  -20.293200
C     -13.471300   14.990100  -19.589300
H     -13.322300   15.800900  -18.850000
H     -14.397400   14.466500  -19.281400
C     -13.656200   15.588600  -20.982200
H     -14.504100   16.281800  -21.008300
H     -12.768000   16.144300  -21.304000
H     -13.843600   14.811100  -21.731600
C      -2.444100    3.600600    4.530800
C      -2.402100    2.480400    4.987300
C      -2.348400    1.149200    5.474600
C      -2.169700    0.098300    4.555300
C      -2.459400    0.872700    6.850000
C      -2.115400   -1.227400    5.012600
H      -2.068200    0.315700    3.492200
C      -2.394400   -0.455200    7.289600
H      -2.586300    1.688900    7.566300
C      -1.928700   -2.298200    4.104600
C      -2.233700   -1.508500    6.387400
C      -2.354200   -0.748900    8.764900
C      -1.766800   -3.235500    3.357600
H      -2.185600   -2.540900    6.740900
O      -1.354400   -0.455800    9.418700
N      -3.461400   -1.367000    9.312200
C      -1.585200   -4.367800    2.523900
H      -4.231100   -1.727800    8.717800
C      -3.555600   -1.683400   10.763200
C      -1.324900   -5.619600    3.107600
C      -1.666800   -4.258000    1.125300
H      -3.074900   -2.684500   10.951900
C      -2.919500   -0.601700   11.619500
C      -5.027300   -1.746600   11.195300
C      -1.182400   -6.729400    2.259200
H      -1.225300   -5.726800    4.185300
C      -1.490500   -5.418600    0.346000
H      -1.871100   -3.295400    0.663900
H      -3.161400   -0.723600   12.685400
H      -1.820500   -0.608600   11.519400
H      -3.256900    0.401400   11.295100
O      -6.022400   -1.360400   10.627600
O      -5.077900   -2.316900   12.451800
N      -1.278000   -6.641900    0.912000
H      -0.964600   -7.729900    2.660000
C      -1.530500   -5.354500   -1.146200
C      -6.417700   -2.561000   12.997600
N      -1.893500   -6.493900   -1.802800
C      -1.224900   -4.162800   -1.832400
H      -7.056200   -1.690500   12.773400
H      -6.793400   -3.454900   12.459600
C      -6.297600   -2.860800   14.488800
C      -2.005200   -6.458800   -3.151600
C      -1.339100   -4.142000   -3.235600
H      -0.897700   -3.275000   -1.297500
H      -6.257100   -1.931300   15.084200
H      -5.354400   -3.398500   14.708600
C      -7.525000   -3.711900   14.854400
C      -1.742000   -5.306000   -3.909900
H      -2.340200   -7.391300   -3.626500
C      -1.069400   -2.957400   -3.970400
H      -8.442200   -3.188800   14.509200
H      -7.485500   -4.665000   14.285100
C      -7.679200   -4.036700   16.343500
H      -1.856800   -5.315900   -4.991700
C      -0.855600   -1.958100   -4.619200
H      -7.720600   -3.109600   16.944500
H      -6.802700   -4.600100   16.713900
C      -8.965400   -4.857900   16.534600
C      -0.595200   -0.758200   -5.329600
H      -9.825700   -4.298400   16.114900
H      -8.898500   -5.793500   15.944400
C      -9.248900   -5.199200   18.000800
C      -0.262600    0.398500   -4.600000
C      -0.652000   -0.713300   -6.736200
H      -9.288500   -4.273900   18.606600
H      -8.419100   -5.799600   18.419600
C     -10.572900   -5.968200   18.130500
C      -0.002600    1.600400   -5.276300
H      -0.199900    0.359100   -3.512200
C      -0.377500    0.491200   -7.395500
H      -0.898900   -1.613600   -7.305000
H     -10.528900   -6.899400   17.533200
H     -11.398500   -5.371400   17.696200
C     -10.886500   -6.301700   19.593800
C       0.341200    2.773700   -4.561900
C      -0.065500    1.649900   -6.682600
C      -0.274600    0.517200   -8.897200
H     -10.064700   -6.905300   20.025500
H     -10.921700   -5.370000   20.191100
C     -12.215400   -7.057300   19.733800
C       0.644000    3.792800   -3.985200
H       0.143500    2.585800   -7.205700
O       0.679900   -0.026900   -9.453900
N      -1.264100    1.193500   -9.582200
H     -12.184400   -7.992900   19.143400
H     -13.040400   -6.457300   19.304000
C     -12.509700   -7.375600   21.205600
C       0.997700    5.012800   -3.355600
H      -1.985200    1.749000   -9.082500
C      -1.298500    1.273200  -11.067700
H     -11.682500   -7.974900   21.632700
H     -12.536200   -6.438200   21.794300
C     -13.834900   -8.130400   21.376700
C       1.453400    6.086500   -4.138300
C       0.894700    5.164300   -1.961600
H      -0.681600    2.154000  -11.402200
C      -0.812200   -0.011500  -11.717500
C      -2.745900    1.463900  -11.550000
H     -13.812700   -9.071500   20.793500
H     -14.667500   -7.533500   20.955900
C     -14.112700   -8.440500   22.846300
C       1.762600    7.294000   -3.491600
H       1.573800    5.984500   -5.214500
C       1.246000    6.403500   -1.390400
H       0.542200    4.340200   -1.347100
H      -1.021000   -0.032300  -12.796600
H       0.274800   -0.142600  -11.580800
H      -1.295300   -0.890000  -11.248200
O      -3.787300    1.312600  -10.961700
O      -2.706200    1.824900  -12.883600
H     -15.057900   -8.980600   22.967200
H     -13.321700   -9.060600   23.283700
H     -14.178500   -7.525400   23.446200
N       1.646600    7.461200   -2.152600
H       2.136400    8.163000   -4.051600
C       1.192800    6.607600    0.088800
C      -3.997500    2.146700  -13.502500
N       1.011500    7.886200    0.529900
C       1.306500    5.520900    0.978300
H      -4.747500    1.415000  -13.159000
H      -4.254900    3.159100  -13.130800
C      -3.825800    2.175700  -15.018200
C       0.890500    8.103100    1.860500
C       1.184700    5.761700    2.359400
H       1.494000    4.514400    0.613200
H      -3.910600    1.163700  -15.453200
H      -2.815600    2.534400  -15.294300
C      -4.913900    3.117500  -15.559200
C       0.965300    7.072800    2.812700
H       0.705400    9.144300    2.158700
H      -5.899800    2.794500  -15.162700
H      -4.741500    4.138100  -15.156200
C      -5.004200    3.202700  -17.086100
H       0.847200    7.287200    3.872400
H      -5.171100    2.201100  -17.522300
H      -4.050900    3.558500  -17.518600
C      -6.152900    4.155900  -17.456300
H      -7.089600    3.811000  -16.973400
H      -5.949700    5.160400  -17.034100
C      -6.375200    4.273200  -18.967500
H      -6.554300    3.272400  -19.404600
H      -5.461700    4.659100  -19.458400
C      -7.564900    5.197700  -19.269200
H      -7.380600    6.201500  -18.840000
H      -8.474300    4.817300  -18.764800
C      -7.817000    5.313200  -20.777200
H      -6.911000    5.703200  -21.280300
H      -7.990900    4.307300  -21.206200
C      -9.014900    6.221900  -21.087000
H      -8.844900    7.231000  -20.665900
H      -9.923300    5.835800  -20.586000
C      -9.250200    6.317200  -22.600300
H      -8.338500    6.699900  -23.098600
H      -9.418400    5.305900  -23.018500
C     -10.442400    7.221500  -22.941300
H     -10.278200    8.235500  -22.527800
H     -11.359400    6.840000  -22.451400
C     -10.660600    7.307800  -24.450700
H     -11.515100    7.948800  -24.693200
H      -9.784100    7.722500  -24.961700
H     -10.856200    6.321400  -24.887000
C       1.262600    4.695400    3.293900
C       1.314200    3.802000    4.108800
C       1.379900    2.722000    5.025900
C       1.530000    1.415700    4.524500
C       1.312100    2.941500    6.415000
C       1.598200    0.330300    5.411900
H       1.601400    1.248100    3.449700
C       1.392400    1.848300    7.286200
H       1.208300    3.957000    6.806300
C       1.760300   -0.989800    4.926700
C       1.522500    0.545600    6.801600
C       1.487800    2.082700    8.770200
C       1.904300   -2.128500    4.544100
H       1.580400   -0.300500    7.490000
O       2.511700    2.571100    9.245500
N       0.403100    1.699100    9.534800
C       2.066900   -3.479000    4.145300
H      -0.390700    1.172400    9.121700
C       0.351100    1.898900   11.008400
C       2.345000   -4.455900    5.115400
C       1.949300   -3.854100    2.795400
H       0.820300    1.010100   11.516200
C       1.032000    3.191000   11.425300
C      -1.107900    2.028100   11.474200
C       2.470800   -5.790000    4.695600
H       2.468000   -4.187100    6.162100
C       2.108000   -5.212600    2.457100
H       1.730700   -3.106300    2.037800
H       0.826500    3.447200   12.475100
H       2.126400    3.125000   11.300100
H       0.695200    4.030600   10.786700
O      -2.111600    2.236700   10.836500
O      -1.132000    1.908200   12.850800
N       2.338000   -6.168900    3.402000
H       2.705400   -6.593900    5.407600
C       2.030900   -5.662600    1.034300
C      -2.459300    1.927900   13.478100
N       1.658600   -6.956600    0.815500
C       2.314300   -4.778400   -0.025400
H      -3.060700    2.721700   13.005800
H      -2.909900    0.939600   13.256700
C      -2.286800    2.102700   14.984600
C       1.511900   -7.383400   -0.461000
C       2.164200   -5.237300   -1.347900
H       2.651300   -3.763000    0.165800
H      -2.216700    3.170900   15.258100
H      -1.341200    1.641000   15.329900
C      -3.504600    1.433300   15.643000
C       1.748200   -6.559200   -1.574000
H       1.171700   -8.421300   -0.579900
C       2.411500   -4.375800   -2.449000
H      -4.428300    1.816700   15.160900
H      -3.482600    0.345000   15.423400
C      -3.624700    1.626700   17.158300
H       1.603200   -6.936600   -2.583900
C       2.605600   -3.657000   -3.403300
H      -3.648100    2.702000   17.414600
H      -2.741100    1.209700   17.676000
C      -4.909000    0.932300   17.643100
C       2.841200   -2.777200   -4.490800
H      -5.777500    1.328100   17.078900
H      -4.860300   -0.147900   17.400400
C      -5.156800    1.107400   19.145000
C       3.186400   -1.440000   -4.218600
C       2.747500   -3.224500   -5.822200
H      -5.179100    2.183200   19.403900
H      -4.317600    0.674900   19.722200
C      -6.478800    0.442200   19.559500
C       3.425500   -0.550700   -5.278000
H       3.275200   -1.098300   -3.187300
C       2.998400   -2.326500   -6.867000
H       2.491400   -4.265800   -6.035200
H      -6.452300   -0.636500   19.312100
H      -7.314600    0.865700   18.969300
C      -6.753800    0.627700   21.056700
C       3.784600    0.795100   -5.021500
C       3.326100   -0.993600   -6.611100
C       3.057200   -2.833500   -8.282800
H      -5.922500    0.195700   21.646800
H      -6.769600    1.707100   21.303400
C      -8.080300   -0.018900   21.479600
C       4.098200    1.948200   -4.832600
H       3.519000   -0.300900   -7.433300
O       3.983900   -3.564100   -8.632000
N       2.056100   -2.418800   -9.139200
H      -8.068300   -1.099800   21.242300
H      -8.915100    0.409900   20.892700
C      -8.333700    0.186800   22.979100
C       4.465300    3.307600   -4.666800
H       1.362900   -1.700100   -8.853300
C       1.976000   -2.871100  -10.554400
H      -7.495400   -0.239700   23.563400
H      -8.342000    1.268900   23.213400
C      -9.654600   -0.449800   23.432400
C       4.892600    4.045900   -5.782700
C       4.404900    3.927200   -3.406000
H       2.586400   -2.176800  -11.197200
C       2.436100   -4.310100  -10.712300
C       0.517600   -2.846000  -11.036300
H      -9.648800   -1.533700   23.205700
H     -10.497900   -0.024000   22.854500
C      -9.891800   -0.236300   24.926200
C       5.220200    5.398600   -5.597100
H       4.977700    3.581900   -6.762800
C       4.769700    5.284300   -3.303500
H       4.073900    3.365500   -2.536600
H       2.187700   -4.718300  -11.703300
H       3.527400   -4.398400  -10.574200
H       1.970700   -4.953700   -9.940800
O      -0.509000   -2.768600  -10.404200
O       0.515800   -2.979900  -12.411700
H     -10.833600   -0.693200   25.249000
H      -9.089500   -0.677500   25.528700
H      -9.940700    0.829300   25.178600
N       5.146100    6.014000   -4.392800
H       5.574700    6.020600   -6.431100
C       4.757900    5.986100   -1.984200
C      -0.798400   -2.907500  -13.063300
N       4.588700    7.339600   -2.008000
C       4.896500    5.272500   -0.777200
H      -1.513400   -3.510900  -12.480200
H      -1.090000   -1.839400  -13.023100
C      -0.651500   -3.366200  -14.511600
C       4.500800    8.004600   -0.832100
C       4.813400    5.978300    0.438400
H       5.071700    4.200000   -0.775700
H      -0.741400   -4.464600  -14.593000
H       0.354700   -3.118500  -14.903100
C      -1.752700   -2.652400  -15.313000
C       4.602300    7.366000    0.415300
H       4.320900    9.085800   -0.907800
H      -2.728800   -2.817800  -14.809400
H      -1.573400   -1.556800  -15.278000
C      -1.882400   -3.082900  -16.778200
H       4.508400    7.934100    1.338100
H      -2.067100   -4.170700  -16.850100
H      -0.939700   -2.897400  -17.325600
C      -3.040200   -2.299400  -17.420200
H      -3.963600   -2.454700  -16.826500
H      -2.826800   -1.213500  -17.365400
C      -3.302400   -2.695000  -18.877200
H      -3.491300   -3.783100  -18.947500
H      -2.402900   -2.503100  -19.492200
C      -4.501000   -1.917600  -19.444000
H      -4.305800   -0.829400  -19.387100
H      -5.396100   -2.095700  -18.816600
C      -4.794700   -2.319200  -20.894500
H      -3.903100   -2.131500  -21.523700
H      -4.980000   -3.409400  -20.951200
C      -6.000900   -1.559400  -21.464500
H      -5.818300   -0.468700  -21.420200
H      -6.893900   -1.740600  -20.836100
C      -6.281400   -1.986700  -22.911400
H      -5.384700   -1.807800  -23.535900
H      -6.461200   -3.078500  -22.952000
C      -7.484700   -1.244300  -23.508700
H      -7.310800   -0.151300  -23.473800
H      -8.386000   -1.426700  -22.891700
C      -7.748600   -1.679800  -24.948900
H      -8.609100   -1.151400  -25.373500
H      -6.887100   -1.477200  -25.595400
H      -7.958800   -2.753700  -25.013200
C       4.923800    5.301800    1.681500
C       5.006300    4.746400    2.753900
C       5.106500    4.045400    3.982900
C       5.231100    2.643800    3.951600
C       5.095300    4.725800    5.214900
C       5.333700    1.924600    5.152400
H       5.254100    2.119000    2.996300
C       5.206300    3.993300    6.403400
H       5.009400    5.815400    5.241200
C       5.472400    0.515300    5.139200
C       5.315400    2.601500    6.387200
C       5.349000    4.720300    7.713700
C       5.599400   -0.687500    5.159700
H       5.398700    2.039500    7.320100
O       6.384800    5.336600    7.960900
N       4.290300    4.625900    8.596300
C       5.749600   -2.094900    5.242000
H       3.482400    4.001200    8.407500
C       4.278900    5.323400    9.910400
C       6.049900   -2.682300    6.482100
C       5.601400   -2.909300    4.105400
H       4.775500    4.667600   10.678800
C       4.952300    6.682400    9.831000
C       2.832800    5.605900   10.346600
C       6.167900   -4.080100    6.542500
H       6.196200   -2.072000    7.370400
C       5.755200   -4.302500    4.249900
H       5.363500   -2.465300    3.142400
H       4.794700    7.276400   10.743100
H       6.040400    6.580800    9.674800
H       4.566600    7.256000    8.965600
O       1.812300    5.590500    9.702300
O       2.844200    5.960500   11.682700
N       6.009800   -4.878300    5.459700
H       6.416300   -4.592800    7.482400
C       5.643000   -5.214700    3.071500
C       1.529100    6.188100   12.295300
N       5.264800   -6.501100    3.323000
C       5.898900   -4.754600    1.764700
H       0.902400    6.753000   11.585200
H       1.102800    5.176600   12.454400
C       1.718200    6.891800   13.635800
C       5.083700   -7.341900    2.277500
C       5.714000   -5.641900    0.687300
H       6.240800   -3.739000    1.584200
H       1.782800    7.987200   13.509000
H       2.672000    6.587800   14.109600
C       0.512500    6.497100   14.505400
C       5.291400   -6.956200    0.942500
H       4.739200   -8.353100    2.534000
C       5.934500   -5.219100   -0.649800
H      -0.421900    6.699100   13.939600
H       0.534800    5.399700   14.675300
C       0.422800    7.202000   15.862700
H       5.119300   -7.658000    0.129300
C       6.108100   -4.882100   -1.799500
H       0.395800    8.299500   15.731400
H       1.320400    6.990500   16.472700
C      -0.845200    6.718100   16.586700
C       6.320700   -4.435200   -3.128500
H      -1.729600    6.899300   15.943100
H      -0.795500    5.620100   16.727400
C      -1.056500    7.398200   17.943100
C       6.660900   -3.085900   -3.340600
C       6.208400   -5.315000   -4.221700
H      -1.080900    8.497500   17.817100
H      -0.199400    7.189000   18.611100
C      -2.361900    6.917800   18.596300
C       6.878100   -2.616900   -4.645300
H       6.761700   -2.409000   -2.492000
C       6.435700   -4.832000   -5.516100
H       5.955400   -6.366000   -4.058700
H      -2.333600    5.819900   18.734500
H      -3.216300    7.113900   17.919700
C      -2.597200    7.608500   19.945000
C       7.232200   -1.265400   -4.877100
C       6.760800   -3.493100   -5.741700
C       6.466600   -5.793000   -6.673800
H      -1.746700    7.404300   20.624000
H      -2.614300    8.706800   19.804500
C      -3.906800    7.151100   20.602400
C       7.542400   -0.119200   -5.107600
H       6.937100   -3.127400   -6.755700
O       7.397200   -6.593400   -6.778200
N       5.437600   -5.697200   -7.589900
H      -3.893100    6.054900   20.753300
H      -4.760800    7.351600   19.927300
C      -4.120400    7.863800   21.944500
C       7.906000    1.212400   -5.430700
H       4.732900   -4.936200   -7.533500
C       5.320200   -6.606400   -8.761600
H      -3.263700    7.663200   22.616500
H      -4.129600    8.960200   21.789700
C      -5.424500    7.427900   22.626200
C       8.298500    1.520300   -6.743900
C       7.878200    2.227700   -4.458600
H       5.915300   -6.181800   -9.617500
C       5.772200   -8.015900   -8.422500
C       3.849300   -6.740200   -9.186600
H      -5.419100    6.332400   22.787600
H      -6.285600    7.631500   21.960300
C      -5.621900    8.145200   23.960300
C       8.626700    2.852300   -7.043000
H       8.356500    0.747500   -7.507100
C       8.243200    3.534700   -4.838100
H       7.571400    2.001300   -3.440900
H       5.528100   -8.733600   -9.219500
H       6.862100   -8.055400   -8.251400
H       5.297200   -8.358500   -7.482200
O       2.839700   -6.472400   -8.582400
O       3.814600   -7.308100  -10.446900
H      -6.552100    7.832200   24.446600
H      -4.801100    7.935400   24.655900
H      -5.669000    9.232500   23.830500
N       8.586800    3.844000   -6.121200
H       8.953800    3.148100   -8.049600
C       8.269300    4.643600   -3.837100
C       2.484100   -7.446000  -11.052200
N       8.094700    5.910600   -4.312600
C       8.447800    4.379700   -2.464800
H       1.776600   -7.784600  -10.277200
H       2.211400   -6.426400  -11.393200
C       2.575100   -8.388900  -12.248600
C       8.040300    6.934400   -3.428500
C       8.399300    5.454900   -1.558000
H       8.627800    3.369600   -2.105800
H       2.474100   -9.443900  -11.937400
H       3.566800   -8.313300  -12.735800
C       1.447800   -7.976100  -13.210100
C       8.182800    6.755100   -2.042500
H       7.853300    7.927500   -3.859900
H       0.490500   -7.936600  -12.647800
H       1.636800   -6.939900  -13.562600
C       1.258900   -8.882900  -14.430400
H       8.116100    7.602700   -1.364100
H       1.070300   -9.926000  -14.116200
H       2.179300   -8.911400  -15.042300
C       0.078000   -8.351000  -15.260600
H      -0.824700   -8.288100  -14.620000
H       0.290100   -7.312400  -15.583400
C      -0.229400   -9.215000  -16.487900
H      -0.417500  -10.260800  -16.178300
H       0.650800   -9.250900  -17.157600
C      -1.447100   -8.667900  -17.249100
H      -1.255500   -7.625900  -17.569700
H      -2.322900   -8.618000  -16.573200
C      -1.778900   -9.537100  -18.468100
H      -0.905800   -9.577700  -19.147800
H      -1.959000  -10.580900  -18.145100
C      -3.004100   -9.012900  -19.230100
H      -2.827300   -7.972500  -19.563200
H      -3.880500   -8.968100  -18.555500
C      -3.317400   -9.905600  -20.438300
H      -2.438000   -9.950800  -21.109600
H      -3.490800  -10.945900  -20.101100
C      -4.539700   -9.406500  -21.220700
H      -4.370200   -8.367800  -21.565000
H      -5.423500   -9.364100  -20.554700
C      -4.839100  -10.305600  -22.418900
H      -5.709900   -9.946700  -22.978000
H      -3.994000  -10.343000  -23.115900
H      -5.050700  -11.334900  -22.107200
C       8.550700    5.237100   -0.163800
C       8.668300    5.076400    1.030100
C       8.806800    4.853200    2.423400
C       8.934100    3.533900    2.896000
C       8.829500    5.931100    3.327800
C       9.072000    3.295800    4.272500
H       8.931600    2.699800    2.194200
C       8.975300    5.676000    4.696800
H       8.744300    6.957500    2.961900
C       9.212500    1.973300    4.758400
C       9.087200    4.371600    5.181500
C       9.143100    6.836700    5.639500
C       9.340700    0.851400    5.192900
H       9.198000    4.183200    6.251500
O      10.164600    7.519400    5.596600
N       8.110500    7.061500    6.532900
C       9.491900   -0.443400    5.749600
H       7.323300    6.393400    6.634800
C       8.111400    8.222700    7.461300
C       9.831700   -0.575400    7.106100
C       9.305900   -1.595300    4.965000
H       8.714400    7.962800    8.376000
C       8.653200    9.470500    6.786300
C       6.681800    8.586300    7.885700
C       9.947400   -1.869800    7.637500
H      10.009600    0.299800    7.727000
C       9.462500   -2.857000    5.572200
H       9.038300   -1.504500    3.915500
H       8.500100   10.367300    7.404900
H       9.735600    9.364900    6.588300
H       8.182000    9.639100    5.799700
O       5.625000    8.304600    7.375300
O       6.759500    9.407100    8.997000
N       9.753300   -2.988100    6.898400
H      10.224000   -2.033600    8.688300
C       9.317700   -4.114500    4.778200
C       5.475600    9.781300    9.601900
N       8.945400   -5.235700    5.460300
C       9.541900   -4.127100    3.387200
H       4.764000   10.024300    8.794800
H       5.140000    8.876000   10.147800
C       5.683900   10.926100   10.588900
C       8.738200   -6.379600    4.766500
C       9.330600   -5.325500    2.679600
H       9.880000   -3.236200    2.864400
H       5.711100   11.903700   10.075600
H       6.657600   10.830900   11.106900
C       4.510800   10.843600   11.581400
C       8.913300   -6.471400    3.375700
H       8.399200   -7.241200    5.358000
C       9.518900   -5.384200    1.274000
H       3.557200   10.840600   11.011600
H       4.552900    9.866500   12.108500
C       4.451500   11.960600   12.627800
H       8.719900   -7.405500    2.853000
C       9.663100   -5.459800    0.074500
H       4.420000   12.951800   12.139300
H       5.363600   11.958400   13.253100
C       3.202200   11.752000   13.501300
C       9.839200   -5.512300   -1.331500
H       2.302400   11.708300   12.855100
H       3.260000   10.765000   14.001700
C       3.019600   12.849600   14.554300
C      10.170600   -4.333200   -2.024300
C       9.698200   -6.725100   -2.031600
H       2.995300   13.842800   14.066400
H       3.890000   12.868800   15.237400
C       1.727700   12.630600   15.357100
C      10.349400   -4.368000   -3.416200
H      10.294000   -3.396800   -1.480100
C       9.886900   -6.743100   -3.418900
H       9.453500   -7.644900   -1.494100
H       1.756400   11.644300   15.858900
H       0.858600   12.593600   14.671800
C       1.525100   13.740100   16.396100
C      10.695500   -3.191400   -4.124000
C      10.201200   -5.578400   -4.121100
C       9.875900   -8.064300   -4.139000
H       2.391100   13.769700   17.085500
H       1.507300   14.725900   15.891700
C       0.230900   13.547000   17.198500
C      10.998500   -2.200700   -4.748700
H      10.343800   -5.602400   -5.203700
O      10.776200   -8.878300   -3.942100
N       8.827800   -8.280100   -5.016700
H       0.244800   12.567000   17.712300
H      -0.639100   13.516000   16.514900
C       0.053800   14.675400   18.223400
C      11.352100   -1.065300   -5.520300
H       8.157600   -7.526500   -5.259600
C       8.651200   -9.571800   -5.731100
H       0.927000   14.704900   18.903500
H       0.044000   15.654100   17.705600
C      -1.233400   14.512400   19.042900
C      11.724200   -1.230500   -6.864500
C      11.334800    0.223600   -4.958700
H       9.291600   -9.571100   -6.657300
C       8.987300  -10.750700   -4.835000
C       7.184700   -9.782200   -6.132600
H      -1.227400   13.536700   19.566600
H      -2.111200   14.488200   18.368200
C      -1.393100   15.642800   20.057900
C      12.043000   -0.084300   -7.610200
H      11.773500   -2.219500   -7.314600
C      11.690600    1.318100   -5.771500
H      11.043200    0.363500   -3.921000
H       8.697700  -11.707300   -5.295000
H      10.071800  -10.780000   -4.623900
H       8.491300  -10.669800   -3.849400
O       6.181100   -9.260300   -5.712300
O       7.142100  -10.786500   -7.084000
H      -2.311200   15.524900   20.643400
H      -0.554800   15.672600   20.763400
H      -1.440300   16.621500   19.566600
N      12.013900    1.165100   -7.087400
H      12.353300   -0.155000   -8.661900
C      11.733200    2.703200   -5.212800
C       5.820700  -11.063300   -7.658900
N      11.539100    3.731600   -6.087200
C      11.949400    2.922300   -3.837700
H       5.073300  -11.046600   -6.847700
H       5.635600  -10.229900   -8.367400
C       5.853100  -12.383500   -8.423400
C      11.503700    4.996600   -5.604400
C      11.920800    4.242500   -3.351800
H      12.144200    2.094600   -3.160500
H       5.723700  -13.247000   -7.747200
H       6.832500  -12.532400   -8.917500
C       4.712500  -12.297800   -9.453100
C      11.685500    5.300200   -4.245100
H      11.298900    5.783500   -6.343400
H       3.768600  -12.046800   -8.923600
H       4.910500  -11.447500  -10.140200
C       4.482500  -13.559400  -10.290600
H      11.632600    6.328400   -3.894400
H       4.291700  -14.431100   -9.638000
H       5.386300  -13.808600  -10.876700
C       3.285000  -13.318900  -11.226500
H       2.401300  -13.025400  -10.625000
H       3.498000  -12.456400  -11.888700
C       2.937500  -14.544400  -12.077800
H       2.755500  -15.419500  -11.425100
H       3.797300  -14.817800  -12.718600
C       1.699300  -14.275700  -12.947600
H       1.884000  -13.409400  -13.611300
H       0.843700  -13.986300  -12.307100
C       1.330700  -15.507000  -13.784300
H       2.184100  -15.789200  -14.430800
H       1.158000  -16.374000  -13.117100
C       0.085100  -15.263600  -14.647900
H       0.253400  -14.403500  -15.323500
H      -0.771400  -14.979600  -14.006900
C      -0.262800  -16.514600  -15.465800
H       0.597700  -16.797800  -16.102400
H      -0.428000  -17.372900  -14.786000
C      -1.505400  -16.304000  -16.341700
H      -1.345100  -15.448500  -17.026300
H      -2.371400  -16.027500  -15.709400
C      -1.835800  -17.557300  -17.150300
H      -2.722600  -17.405500  -17.775100
H      -1.010300  -17.837700  -17.814600
H      -2.036100  -18.415800  -16.499000
C      12.113500    4.515100   -1.972500
C      12.269000    4.777200   -0.801200
C      12.457500    5.072800    0.572400
C      12.589100    4.022200    1.498800
C      12.530300    6.407500    1.009200
C      12.786100    4.311500    2.858900
H      12.545400    2.987300    1.159500
C      12.730400    6.680500    2.368600
H      12.444000    7.225300    0.289200
C      12.942300    3.250600    3.785200
C      12.850700    5.648000    3.300900
C      12.928000    8.117700    2.768800
C      13.089600    2.342300    4.570600
H      13.004900    5.868100    4.359200
O      13.910500    8.741900    2.380300
N      11.943200    8.680900    3.566700
C      13.280500    1.311300    5.525600
H      11.173600    8.119300    3.972700
C      11.949400   10.136900    3.867700
C      13.715600    1.642800    6.819600
C      13.049100   -0.036400    5.196500
H      12.725000   10.344500    4.657700
C      12.214300   10.964500    2.617000
C      10.574700   10.602000    4.358200
C      13.892200    0.604400    7.747500
H      13.920600    2.675300    7.093500
C      13.268400   -1.018600    6.182800
H      12.700300   -0.305600    4.202800
H      12.040000   12.031300    2.804900
H      13.259000   10.819200    2.282400
H      11.593200   10.659100    1.760900
O       9.481100   10.163000    4.096200
O      10.743700   11.731900    5.138900
N      13.667900   -0.697400    7.446500
H      14.242600    0.804600    8.769300
C      13.072700   -2.468900    5.880800
C       9.527600   12.212000    5.804400
N      12.694100   -3.267900    6.919600
C      13.256000   -2.972500    4.578200
H       8.672700   12.063200    5.118500
H       9.435400   11.562400    6.701400
C       9.664700   13.661300    6.256200
C      12.443300   -4.576100    6.675000
C      13.000000   -4.336300    4.339600
H      13.598000   -2.331100    3.770200
H       9.633500   14.363400    5.405000
H      10.636500   13.833100    6.755900
C       8.486600   13.889200    7.222700
C      12.578600   -5.153800    5.401900
H      12.099600   -5.165800    7.536100
C      13.148600   -4.889600    3.048000
H       7.536000   13.676900    6.688900
H       8.543700   13.144600    8.045700
C       8.405300   15.288600    7.837900
H      12.350600   -6.205300    5.242300
C      13.262300   -5.397800    1.942700
H       8.347300   16.057700    7.045900
H       9.322100   15.512800    8.414600
C       7.168700   15.366300    8.750600
C      13.403200   -5.963000    0.655700
H       6.261300   15.105100    8.170200
H       7.244600   14.601300    9.548500
C       6.993300   16.751800    9.380700
C      13.696400   -5.127500   -0.437100
C      13.268700   -7.349900    0.464000
H       6.948500   17.522900    8.587700
H       7.879000   17.001200    9.995900
C       5.723100   16.818500   10.242900
C      13.847400   -5.681200   -1.718900
H      13.813000   -4.054100   -0.286900
C      13.426000   -7.887600   -0.820200
H      13.055900   -8.003000    1.314000
H       5.771400   16.062200   11.049300
H       4.837500   16.552400    9.634100
C       5.543000   18.217900   10.845000
C      14.165900   -4.837100   -2.811200
C      13.705500   -7.069300   -1.915800
C      13.398400   -9.385700   -0.959500
H       6.428200   18.477100   11.457800
H       5.506900   18.970300   10.032900
C       4.273800   18.323800   11.701800
C      14.453600   -4.110900   -3.735000
H      13.825900   -7.495900   -2.913800
O      14.268500  -10.076200   -0.435900
N      12.344200   -9.920900   -1.684500
H       4.305800   17.581900   12.522100
H       3.383900   18.065700   11.096600
C       4.125800   19.739100   12.277600
C      14.803300   -3.297800   -4.842700
H      11.674200   -9.325500   -2.203300
C      12.125800  -11.390700   -1.736200
H       5.019700   19.994700   12.878900
H       4.098400   20.477800   11.453100
C       2.865000   19.882800   13.140700
C      15.173100   -3.904200   -6.054700
C      14.792000   -1.894800   -4.744100
H      12.865300  -11.846600   -2.453200
C      12.249300  -12.022400   -0.355800
C      10.699400  -11.719000   -2.187800
H       2.889500   19.150500   13.970900
H       1.967100   19.632900   12.542600
C       2.732600   21.296800   13.703600
C      15.511900   -3.074900   -7.135200
H      15.207500   -4.987200   -6.151100
C      15.161400   -1.136400   -5.872600
H      14.494900   -1.414100   -3.815800
H      11.914400  -13.067200   -0.367900
H      13.301000  -11.981000   -0.013900
H      11.675600  -11.484400    0.414300
O       9.685600  -11.080000   -2.042300
O      10.695700  -12.979900   -2.758300
H       1.832100   21.396500   14.319500
H       3.590900   21.563600   14.330800
H       2.668700   22.044600   12.904700
N      15.501900   -1.722300   -7.056200
H      15.823800   -3.494400   -8.101800
C      15.189600    0.357100   -5.820300
C       9.424400  -13.377200   -3.373000
N      14.962300    1.014500   -6.993500
C      15.417000    1.043900   -4.610600
H       8.598200  -12.981300   -2.753100
H       9.441800  -12.889600   -4.371400
C       9.335000  -14.887000   -3.561900
C      14.906100    2.367400   -6.981300
C      15.365800    2.449800   -4.613900
H      15.635200    0.505500   -3.692100
H       9.189500  -15.413200   -2.602600
H      10.270800  -15.291500   -3.991400
C       8.141000  -15.099000   -4.512500
C      15.097500    3.127100   -5.815800
H      14.674600    2.844400   -7.943800
H       7.232000  -14.650800   -4.057900
H       8.317800  -14.529600   -5.450200
C       7.847000  -16.556300   -4.877400
H      15.027800    4.212000   -5.843200
H       7.669300  -17.156800   -3.966300
H       8.719900  -17.014300   -5.378700
C       6.616700  -16.605300   -5.800500
H       5.760100  -16.110200   -5.301300
H       6.813600  -16.015300   -6.717400
C       6.230400  -18.036600   -6.186300
H       6.062500  -18.639700   -5.273400
H       7.069500  -18.522200   -6.720600
C       4.969600  -18.059800   -7.064300
H       5.138400  -17.472800   -7.987200
H       4.132700  -17.559700   -6.539600
C       4.578100  -19.499400   -7.421000
H       5.415800  -19.992700   -7.951500
H       4.422400  -20.083500   -6.492900
C       3.311700  -19.560000   -8.286000
H       3.461500  -18.987300   -9.220900
H       2.469900  -19.067700   -7.762900
C       2.948800  -21.015200   -8.612700
H       3.795400  -21.505300   -9.131500
H       2.802500  -21.584700   -7.674400
C       1.685500  -21.114400   -9.478200
H       1.827700  -20.550800  -10.420600
H       0.833900  -20.630900   -8.961200
C       1.339800  -22.568600   -9.793400
H       0.439100  -22.638100  -10.412900
H       2.151300  -23.066700  -10.336400
H       1.155500  -23.146000   -8.880100
C      15.574900    3.202900   -3.429500
C      15.748400    3.893800   -2.450900
C      15.984400    4.696400   -1.304900
C      16.119100    4.091700   -0.045300
C      16.130900    6.090200   -1.433600
C      16.406200    4.879900    1.084000
H      16.020900    3.010100    0.055600
C      16.411300    6.866700   -0.300800
H      16.050100    6.558800   -2.416300
C      16.635000    4.224600    2.320500
C      16.536400    6.278300    0.959900
C      16.707600    8.328800   -0.522100
C      16.888400    3.610100    3.332100
H      16.747400    6.889200    1.839900
O      17.735400    8.695500   -1.072300
N      15.732500    9.228100   -0.103700
C      17.277000    2.900400    4.497600
H      14.908700    8.923600    0.437900
C      15.845700   10.680600   -0.421000
C      18.054700    3.548100    5.474600
C      16.947400    1.544200    4.670400
H      16.680300   11.124700    0.191700
C      16.092400   10.941000   -1.906000
C      14.514300   11.341000   -0.047800
C      18.516800    2.796700    6.564800
H      18.300300    4.603300    5.380100
C      17.446800    0.868600    5.801900
H      16.318300    1.030200    3.947400
H      16.107800   12.014800   -2.127600
H      17.071300   10.525900   -2.209900
H      15.334500   10.468900   -2.543200
O      13.409600   10.850300   -0.098200
O      14.713300   12.634900    0.387700
N      18.241900    1.478400    6.725200
H      19.136100    3.252600    7.347900
C      17.103700   -0.565700    6.043800
C      13.544200   13.218800    1.063500
N      16.670900   -0.871900    7.299500
C      17.193500   -1.524300    5.017000
H      12.629900   12.835900    0.565300
H      13.627400   12.831100    2.100000
C      13.579900   14.740400    1.066000
C      16.300800   -2.150200    7.560000
C      16.808500   -2.847300    5.304600
H      17.559100   -1.257700    4.028300
H      13.483300   15.149700    0.044000
H      14.545200   15.116500    1.452800
C      12.407400   15.183800    1.963800
C      16.352700   -3.168100    6.593800
H      15.926700   -2.344900    8.575600
C      16.865300   -3.863200    4.314000
H      11.461400   14.761700    1.564800
H      12.531200   14.744700    2.976000
C      12.258200   16.701700    2.099800
H      16.034900   -4.179600    6.839400
C      16.903800   -4.760200    3.499800
H      12.160900   17.166600    1.100700
H      13.169900   17.136000    2.551800
C      11.028900   17.040700    2.961700
C      16.983800   -5.794700    2.534700
H      10.121500   16.587500    2.516700
H      11.132200   16.581600    3.964000
C      10.836900   18.555400    3.100700
C      17.201400   -5.471300    1.183600
C      16.894700   -7.144400    2.924900
H      10.766100   19.015300    2.095600
H      11.730900   19.003600    3.576000
C       9.584700   18.909700    3.917700
C      17.336800   -6.496300    0.230000
H      17.284400   -4.427700    0.878400
C      17.025900   -8.157100    1.965200
H      16.748400   -7.398000    3.976600
H       9.654100   18.472300    4.931600
H       8.687200   18.456400    3.455400
C       9.416400   20.432600    4.009100
C      17.659600   -6.142800   -1.105000
C      17.231300   -7.847000    0.618700
C      17.080300   -9.581400    2.458900
H      10.318100   20.878400    4.473100
H       9.359700   20.860100    2.988400
C       8.171100   20.843900    4.806400
C      18.004000   -5.799600   -2.213700
H      17.327200   -8.640000   -0.126200
O      18.025700   -9.995100    3.111700
N      15.984800  -10.383400    2.155600
H       8.219000   20.430500    5.831400
H       7.264200   20.406200    4.347600
C       8.046100   22.373400    4.860100
C      18.496500   -5.413900   -3.487400
H      15.223900  -10.054900    1.541000
C      15.867700  -11.760900    2.714400
H       8.957300   22.808600    5.314600
H       8.001100   22.781300    3.831500
C       6.809600   22.826900    5.647800
C      19.176900   -6.354500   -4.282600
C      18.369900   -4.092200   -3.947700
H      16.627300  -12.424400    2.211900
C      16.061000  -11.798900    4.229200
C      14.453200  -12.266500    2.412300
H       6.851500   22.427400    6.679600
H       5.894500   22.398800    5.194400
C       6.701200   24.350500    5.688000
C      19.745100   -5.921900   -5.489000
H      19.269300   -7.389300   -3.961700
C      18.973000   -3.743800   -5.174000
H      17.817800   -3.354200   -3.369600
H      15.906000  -12.807900    4.628900
H      17.091300  -11.492200    4.490100
H      15.383300  -11.113200    4.752300
O      13.437200  -11.613900    2.339900
O      14.453300  -13.631600    2.210500
H       5.820000   24.671200    6.254400
H       7.580000   24.804700    6.159800
H       6.617700   24.776900    4.681700
N      19.668800   -4.639900   -5.927000
H      20.293100   -6.614300   -6.140400
C      18.872500   -2.345900   -5.688800
C      13.213600  -14.140700    1.603600
N      18.507100   -2.191600   -6.992100
C      19.119200   -1.250800   -4.838100
H      12.366300  -13.542100    1.996700
H      13.365300  -13.957500    0.519700
C      13.011600  -15.626800    1.863500
C      18.364400   -0.930800   -7.471600
C      18.967700    0.041400   -5.352000
H      19.427600   -1.404500   -3.807800
H      12.847600  -15.831900    2.936700
H      13.908400  -16.208000    1.578800
C      11.787200  -16.035200    1.020300
C      18.582300    0.213200   -6.682100
H      18.041500   -0.849600   -8.518200
H      19.146400    0.907000   -4.714200
H      10.917000  -15.411200    1.313800
H      11.980500  -15.800600   -0.047600
C      11.403600  -17.512600    1.142000
H      18.439400    1.205100   -7.104600
H      11.230800  -17.776900    2.202300
H      12.239400  -18.152400    0.800500
C      10.140700  -17.805500    0.312100
H       9.311300  -17.149500    0.640400
H      10.321000  -17.550000   -0.750100
C       9.717100  -19.274400    0.429400
H       9.571600  -19.535600    1.495800
H      10.533100  -19.928900    0.066400
C       8.428900  -19.572300   -0.353500
H       8.569800  -19.335700   -1.425000
H       7.610200  -18.914300   -0.004700
C       8.026900  -21.044100   -0.186000
H       8.850300  -21.696500   -0.536900
H       7.899600  -21.272600    0.890600
C       6.736900  -21.394100   -0.940300
H       6.856500  -21.180400   -2.019300
H       5.906900  -20.748700   -0.595300
C       6.375200  -22.871900   -0.733100
H       7.210300  -23.513600   -1.074900
H       6.260100  -23.081200    0.348300
C       5.088800  -23.263600   -1.472400
H       5.197100  -23.059100   -2.555100
H       4.247200  -22.632000   -1.127700
C       4.749000  -24.737600   -1.256900
H       3.829700  -25.014600   -1.784300
H       5.547700  -25.393500   -1.621800
H       4.600100  -24.965700   -0.195200

1460
poly(1-2) s-trans 18-mer left-handed PM7 optimized
N     -13.164500  -10.546900   -7.973600
C     -13.305000  -11.892800   -8.034200
C     -12.219100  -12.770400   -8.173100
C     -10.925100  -12.225300   -8.255600
C     -10.762000  -10.830800   -8.186500
C     -11.905200  -10.020200   -8.047200
N     -10.564100   -8.002400   -8.150400
C     -10.425900   -6.655400   -8.114700
C     -11.505300   -5.779400   -7.923500
C     -12.790300   -6.326200   -7.756400
C     -12.948300   -7.723400   -7.780900
C     -11.813500   -8.532200   -7.984800
H     -14.333400  -12.269600   -7.973300
H     -12.372800  -13.845800   -8.224000
H      -9.768100  -10.378100   -8.246700
H      -9.405800   -6.276300   -8.252300
H     -11.353100   -4.703100   -7.911100
H     -13.933900   -8.180100   -7.650400
C      -9.812500  -13.088600   -8.422500
C      -8.888300  -13.853300   -8.582300
C      -7.821100  -14.765100   -8.781600
C      -6.507200  -14.294600   -8.946600
C      -8.087900  -16.147400   -8.823500
C      -5.460400  -15.208800   -9.155600
H      -6.301500  -13.223600   -8.917600
C      -7.036300  -17.043700   -9.031100
H      -9.108700  -16.513200   -8.701100
C      -5.724700  -16.590700   -9.199200
C      -4.132100  -14.736800   -9.325000
C      -7.330100  -18.518700   -9.107800
H      -4.910500  -17.297100   -9.369000
C      -3.003800  -14.335400   -9.471000
O      -7.630400  -19.105100  -10.133300
N      -7.257300  -19.164600   -7.877000
H      -2.035900  -13.993700   -9.596200
H      -6.905300  -18.689500   -7.030200
C      -7.415200  -20.631400   -7.771200
H      -8.046500  -21.002300   -8.631600
C      -6.054500  -21.327800   -7.775100
C      -8.150500  -20.926300   -6.458000
H      -6.155300  -22.400400   -7.562300
H      -5.567100  -21.221900   -8.753300
H      -5.379100  -20.897600   -7.019900
O      -8.669100  -20.167200   -5.671900
O      -8.164700  -22.284700   -6.227500
C      -8.754200  -22.699900   -4.947100
H      -8.169900  -22.204300   -4.144900
H      -9.796400  -22.339400   -4.920800
C      -8.636600  -24.219500   -4.930500
H      -7.648200  -24.526700   -5.328900
H      -9.379300  -24.667700   -5.618600
C      -8.830200  -24.730900   -3.497400
H      -7.959500  -24.429500   -2.880200
H      -9.709800  -24.234300   -3.040100
C      -9.016700  -26.252700   -3.428200
H      -8.158200  -26.768000   -3.898900
H      -9.905900  -26.552600   -4.015200
C      -9.169500  -26.702900   -1.968200
H      -8.232500  -26.489900   -1.416400
H      -9.957500  -26.099400   -1.474700
C      -9.517200  -28.192200   -1.836300
H      -8.733100  -28.811800   -2.310500
H     -10.450800  -28.414800   -2.387400
C      -9.673500  -28.576300   -0.357800
H     -10.432400  -27.923800    0.117600
H      -8.725200  -28.378000    0.179300
C     -10.073600  -30.045900   -0.169500
H     -11.017400  -30.255100   -0.708200
H      -9.313600  -30.708700   -0.625000
C     -10.235600  -30.376600    1.321100
H     -10.994500  -29.706600    1.771000
H      -9.288900  -30.162300    1.855500
C     -10.636500  -31.839400    1.551600
H     -11.579200  -32.064800    1.018000
H      -9.876100  -32.514800    1.115400
C     -10.800500  -32.136500    3.049300
H     -11.572900  -31.469200    3.480900
H      -9.859700  -31.896100    3.584400
C     -11.177700  -33.592100    3.311200
H     -11.281500  -33.784400    4.385400
H     -12.129800  -33.855800    2.837200
H     -10.418100  -34.281800    2.926200
C     -13.904400   -5.464300   -7.585900
C     -14.838400   -4.703700   -7.461200
C     -15.920400   -3.795400   -7.335600
C     -15.660500   -2.416100   -7.230300
C     -17.247500   -4.265800   -7.338200
C     -16.728500   -1.508500   -7.130400
H     -14.632500   -2.051600   -7.235400
C     -18.301800   -3.352700   -7.230400
H     -17.449000   -5.334900   -7.434300
C     -16.485100   -0.116300   -7.059400
C     -18.056600   -1.981100   -7.123400
C     -19.720100   -3.863400   -7.274300
C     -16.302100    1.087300   -7.019800
H     -18.887100   -1.277200   -7.043100
O     -20.248500   -4.311000   -8.275300
N     -20.405600   -3.718400   -6.063500
C     -16.152100    2.494800   -6.996100
H     -19.871900   -3.562500   -5.192300
C     -21.728800   -4.365100   -5.867500
C     -17.300500    3.307000   -6.954300
C     -14.885500    3.103900   -7.031700
H     -22.388000   -4.120900   -6.748600
C     -21.597100   -5.879200   -5.708100
C     -22.340200   -3.760000   -4.599000
C     -17.135500    4.700100   -6.960300
H     -18.293100    2.863600   -6.925800
C     -14.807000    4.511100   -7.039700
H     -13.973000    2.501600   -7.060700
H     -22.547800   -6.336700   -5.406500
H     -21.286000   -6.340700   -6.656200
H     -20.842100   -6.139300   -4.948400
O     -21.926300   -2.854700   -3.906800
O     -23.505900   -4.411300   -4.269600
N     -15.921800    5.300400   -7.005800
H     -18.000900    5.373800   -6.934500
C     -13.500000    5.230200   -7.101900
C     -24.125300   -3.997300   -2.999600
N     -12.394700    4.441700   -7.257900
C     -13.413000    6.634300   -7.018900
H     -23.352700   -4.098100   -2.209500
H     -24.415700   -2.938400   -3.098800
C     -25.308800   -4.939400   -2.811000
C     -11.181600    5.040100   -7.330700
C     -12.148600    7.242400   -7.108600
H     -14.318300    7.234900   -6.892700
H     -25.044400   -5.952700   -3.178100
H     -26.158200   -4.615000   -3.443000
C     -25.710700   -4.987700   -1.330500
C     -11.009400    6.430600   -7.263000
H     -10.323900    4.367800   -7.453500
H     -24.948000   -5.555300   -0.759700
H     -25.700300   -3.962700   -0.905800
C     -27.096800   -5.612300   -1.115900
H     -10.018400    6.872500   -7.335100
H     -27.115300   -6.646000   -1.509300
H     -27.855800   -5.054700   -1.698300
C     -27.472400   -5.607100    0.373400
H     -26.757800   -6.234900    0.940600
H     -27.364200   -4.581200    0.779800
C     -28.904700   -6.102900    0.619800
H     -29.008200   -7.150100    0.278200
H     -29.618800   -5.515700    0.010800
C     -29.274400   -5.994300    2.106400
H     -29.148100   -4.946700    2.445400
H     -28.569000   -6.595000    2.712700
C     -30.713500   -6.452200    2.383000
H     -31.421600   -5.871100    1.761800
H     -30.840900   -7.508000    2.077200
C     -31.066700   -6.290200    3.868300
H     -30.916700   -5.235700    4.174900
H     -30.367400   -6.886600    4.486100
C     -32.511700   -6.711300    4.168300
H     -33.215500   -6.103300    3.568400
H     -32.675900   -7.759100    3.853200
C     -32.834700   -6.559800    5.661700
H     -32.643500   -5.514700    5.983100
H     -32.147300   -7.190200    6.259700
C     -34.280200   -6.932500    5.981500
H     -34.484400   -6.831300    7.054300
H     -34.990700   -6.289100    5.451100
H     -34.503200   -7.967800    5.701700
C     -11.989300    8.652400   -7.063600
C     -11.797600    9.847700   -7.048000
C     -11.539100   11.243500   -7.049000
C     -10.206400   11.697900   -7.053000
C     -12.599900   12.168700   -7.067200
C      -9.936400   13.076200   -7.074600
H      -9.384800   10.980600   -7.047500
C     -12.317200   13.539000   -7.083200
H     -13.633700   11.816200   -7.077900
C      -8.600900   13.555200   -7.109600
C     -10.999500   14.001900   -7.082600
C     -13.456700   14.525200   -7.148700
C      -7.474800   13.996800   -7.160300
H     -10.790900   15.073500   -7.095500
O     -14.155600   14.689400   -8.132000
N     -13.600400   15.294700   -5.989300
C      -6.179900   14.572700   -7.241200
H     -13.168300   14.973000   -5.107200
C     -14.792000   16.164500   -5.812000
C      -6.055000   15.972700   -7.308600
C      -5.018700   13.780900   -7.271800
H     -14.939400   16.775000   -6.747000
C     -16.046900   15.346400   -5.508700
C     -14.493400   17.102400   -4.637400
C      -4.769700   16.525500   -7.412200
H      -6.935600   16.610600   -7.287900
C      -3.764900   14.415200   -7.382000
H      -5.080900   12.690400   -7.218600
H     -16.890900   15.991500   -5.233900
H     -16.344100   14.757600   -6.388000
H     -15.877400   14.641500   -4.678600
O     -13.477100   17.219200   -3.987900
O     -15.602000   17.860700   -4.340000
N      -3.642800   15.774300   -7.452600
H      -4.622300   17.611000   -7.471500
C      -2.489100   13.641700   -7.442500
C     -15.482100   18.712100   -3.145800
N      -2.620400   12.282600   -7.501300
C      -1.229300   14.273600   -7.451200
H     -15.141200   18.063800   -2.311600
H     -14.715700   19.475600   -3.357800
C     -16.876000   19.290700   -2.926300
C      -1.496500   11.529100   -7.566600
C      -0.072000   13.479300   -7.530100
H      -1.160800   15.364600   -7.404300
H     -17.643800   18.529300   -3.173400
H     -17.058700   20.126400   -3.628600
C     -17.017200   19.753200   -1.469600
C      -0.206200   12.079300   -7.584800
H      -1.650900   10.444400   -7.610700
C       1.227600   14.049100   -7.570900
H     -17.024800   18.866100   -0.802200
H     -16.122000   20.340300   -1.179000
C     -18.278400   20.595700   -1.234300
H       0.670600   11.439600   -7.647900
C       2.357400   14.481900   -7.623400
H     -19.182800   19.990200   -1.431500
H     -18.312700   21.434800   -1.955900
C     -18.312700   21.145000    0.199800
C       3.692700   14.956600   -7.706000
H     -18.297700   20.305700    0.923000
H     -17.391000   21.730500    0.391600
C     -19.543700   22.025300    0.461100
C       4.754800   14.032200   -7.710000
C       3.956600   16.336200   -7.809200
H     -20.461100   21.407300    0.428300
H     -19.652200   22.772100   -0.347900
C     -19.443000   22.735200    1.819000
C       6.079100   14.488300   -7.817900
H       4.550200   12.963200   -7.640200
C       5.279500   16.776100   -7.920300
H       3.132000   17.050800   -7.817000
H     -18.444000   23.203600    1.925300
H     -19.517000   21.986600    2.632600
C     -20.526000   23.808600    2.003600
C       7.168700   13.580600   -7.851700
C       6.342200   15.869200   -7.919800
C       5.578600   18.236100   -8.138300
H     -20.413200   24.594500    1.232700
H     -21.528500   23.369100    1.844100
C     -20.442700   24.431000    3.404400
C       8.128900   12.845300   -7.902800
H       7.370600   16.224000   -8.012000
O       5.671400   18.737200   -9.247000
N       5.781700   18.976900   -6.979500
H     -19.427800   24.845700    3.567600
H     -20.576500   23.638000    4.167300
C     -21.484700   25.536000    3.627100
C       9.286500   12.028200   -7.982800
H       5.638400   18.590100   -6.033900
C       6.028800   20.437300   -7.069800
H     -21.300800   26.377700    2.933200
H     -22.497500   25.161900    3.386100
C     -21.445200   26.033700    5.079600
C      10.544700   12.631100   -8.164300
C       9.205100   10.627700   -7.896300
H       6.667100   20.644400   -7.980300
C       4.713300   21.206600   -7.182400
C       6.823500   20.858600   -5.827100
H     -20.421000   26.379600    5.327600
H     -21.658200   25.188200    5.765200
C     -22.438200   27.161300    5.346300
C      11.674900   11.804800   -8.257200
H      10.638100   13.712200   -8.236800
C      10.388500    9.870200   -7.999400
H       8.241500   10.129300   -7.757900
H       4.880100   22.291100   -7.112400
H       4.228000   21.000800   -8.146700
H       4.007900   20.933800   -6.387500
O       7.574300   20.205300   -5.143000
O       6.586400   22.192100   -5.563000
H     -22.396300   27.479700    6.395100
H     -22.228600   28.041400    4.728400
H     -23.468700   26.851800    5.140100
N      11.611300   10.453500   -8.178700
H      12.676100   12.228500   -8.404500
C      10.377700    8.379100   -7.930300
C       7.024400   22.705300   -4.267700
N       9.142800    7.796500   -7.869900
C      11.565000    7.620000   -7.935700
H       6.073700   22.988300   -3.780900
H       7.517700   21.885100   -3.694700
C       7.951600   23.895100   -4.480600
C       9.069700    6.444800   -7.812100
C      11.472700    6.218200   -7.881000
H      12.537300    8.118200   -7.987300
H       7.383700   24.751900   -4.891600
H       8.716700   23.658300   -5.245400
C       8.613100   24.254100   -3.141900
C      10.201900    5.617100   -7.815400
H       8.058300    6.022500   -7.765100
H       7.893200   24.103100   -2.309900
H       9.445400   23.550300   -2.941900
C       9.127900   25.697500   -3.103600
H      10.101200    4.535300   -7.773700
H       8.284700   26.401000   -3.245600
H       9.817700   25.883100   -3.948900
C       9.839100   25.981600   -1.772600
H       9.252900   25.543300   -0.929900
H      10.816500   25.462200   -1.752900
C      10.038900   27.483600   -1.540100
H       9.062100   28.004200   -1.575600
H      10.638700   27.915800   -2.364600
C      10.726800   27.757300   -0.196300
H      11.723300   27.275900   -0.177300
H      10.147100   27.279700    0.629200
C      10.869100   29.262900    0.060800
H      11.442100   29.731100   -0.763500
H       9.872400   29.744800    0.043500
C      11.561500   29.545800    1.399800
H      12.561700   29.072500    1.416200
H      10.987000   29.064800    2.227600
C      11.692200   31.052800    1.655500
H      12.248300   31.530100    0.825300
H      10.691100   31.525200    1.653900
C      12.400600   31.340700    2.985800
H      13.418500   30.905600    2.974800
H      11.859500   30.823300    3.815700
C      12.480900   32.836600    3.276900
H      12.983300   33.029400    4.231800
H      13.041900   33.369000    2.499900
H      11.486200   33.293300    3.331400
C      12.625100    5.390400   -7.898800
C      13.571600    4.635700   -7.919900
C      14.654900    3.719800   -7.950600
C      14.390600    2.340500   -7.848400
C      15.978300    4.178500   -8.092600
C      15.451600    1.420800   -7.889800
H      13.364600    1.986100   -7.742900
C      17.023700    3.251400   -8.130100
H      16.181400    5.247200   -8.181800
C      15.217300    0.024700   -7.808100
C      16.776100    1.880000   -8.029100
C      18.442800    3.706800   -8.345100
C      15.066800   -1.175300   -7.755200
H      17.601600    1.166100   -8.066000
O      18.954300    3.826900   -9.444500
N      19.154100    3.942100   -7.173600
C      14.942100   -2.587800   -7.712500
H      18.720500    3.926800   -6.237800
C      20.566600    4.380500   -7.229700
C      16.087000   -3.387200   -7.884500
C      13.697500   -3.208300   -7.510600
H      21.029400    4.020100   -8.197300
C      20.678400    5.900800   -7.138700
C      21.302400    3.710200   -6.064600
C      15.939600   -4.782100   -7.848700
H      17.061900   -2.932800   -8.046500
C      13.635600   -4.615500   -7.491300
H      12.789400   -2.614000   -7.375700
H      21.727600    6.215500   -7.050800
H      20.259200    6.373400   -8.037300
H      20.135900    6.297700   -6.269200
O      20.938700    2.823700   -5.327100
O      22.561500    4.257100   -5.936400
N      14.745800   -5.394500   -7.658600
H      16.802300   -5.447300   -7.978700
C      12.347900   -5.342800   -7.292100
C      23.350800    3.749400   -4.809300
N      11.225700   -4.563900   -7.245600
C      12.293000   -6.744900   -7.165300
H      22.721100    3.844100   -3.896300
H      23.564800    2.685200   -5.002500
C      24.597600    4.624000   -4.769700
C      10.027100   -5.170100   -7.069400
C      11.041500   -7.359900   -6.987400
H      13.210500   -7.338900   -7.209900
H      24.318300    5.691200   -4.879600
H      25.247800    4.402700   -5.638800
C      25.338100    4.384100   -3.449300
C       9.885200   -6.559300   -6.936300
H       9.155200   -4.505400   -7.037700
C      10.913800   -8.767900   -6.865500
H      24.711000    4.736700   -2.602100
H      25.472600    3.295000   -3.290200
C      26.706400    5.076100   -3.408600
H       8.904400   -7.008200   -6.800800
C      10.751300   -9.963300   -6.763100
H      26.582200    6.174300   -3.460200
H      27.303900    4.799900   -4.298800
C      27.457100    4.681300   -2.130300
C      10.512100  -11.356700   -6.648600
H      26.815500    4.897900   -1.243100
H      27.620900    3.585600   -2.118500
C      28.802300    5.403000   -1.990600
C       9.193000  -11.808800   -6.455800
C      11.570400  -12.280800   -6.739400
H      28.650500    6.499000   -1.989400
H      29.440500    5.189900   -2.869900
C      29.516700    4.966000   -0.704900
C       8.934400  -13.185700   -6.354900
H       8.372400  -11.092800   -6.392000
C      11.297700  -13.648200   -6.634100
H      12.591000  -11.929200   -6.901200
H      29.668900    3.869100   -0.714900
H      28.858400    5.169200    0.173100
C      30.866000    5.672000   -0.525900
C       7.610000  -13.663200   -6.186400
C       9.993300  -14.110500   -6.440200
C      12.402100  -14.658700   -6.800500
H      31.520100    5.461600   -1.394300
H      30.723700    6.769500   -0.517500
C      31.556000    5.221200    0.768400
C       6.489100  -14.101100   -6.059900
H       9.791800  -15.180900   -6.365300
O      12.769600  -15.079900   -7.884400
N      12.946000  -15.121200   -5.607000
H      31.700600    4.123800    0.755800
H      30.885900    5.425700    1.637700
C      32.906100    5.920600    0.967300
C       5.187600  -14.648500   -5.928200
H      12.724600  -14.696400   -4.691700
C      14.058000  -16.099800   -5.621100
H      33.572200    5.707800    0.109000
H      32.767800    7.018800    0.972600
C      33.582000    5.474500    2.271000
C       5.015400  -16.044100   -5.922500
C       4.059200  -13.817200   -5.813400
H      13.939200  -16.776900   -6.519600
C      15.414600  -15.400000   -5.680900
C      13.944800  -16.955600   -4.354700
H      33.750900    4.380400    2.254900
H      32.893100    5.660300    3.131000
C      34.905300    6.197900    2.503700
C       3.713600  -16.555500   -5.806300
H       5.870400  -16.710800   -6.010600
C       2.787800  -14.411100   -5.702700
H       4.162900  -12.728500   -5.813800
H      16.237100  -16.119800   -5.569200
H      15.542200  -14.890800   -6.646500
H      15.520600  -14.644900   -4.890300
O      13.047600  -17.027500   -3.547300
O      15.073700  -17.735300   -4.217500
H      35.359200    5.900700    3.455900
H      35.630500    5.975300    1.712300
H      34.773900    7.285700    2.529000
N       2.616800  -15.767500   -5.700300
H       3.528500  -17.636900   -5.799100
C       1.544400  -13.594800   -5.585600
C      15.118500  -18.570100   -3.009500
N       1.703800  -12.240400   -5.681600
C       0.281800  -14.187100   -5.391100
H      14.951800  -17.899000   -2.139600
H      14.293600  -19.298800   -3.077900
C      16.499800  -19.213900   -3.019300
C       0.605600  -11.453200   -5.582500
C      -0.848600  -13.356600   -5.293600
H       0.187700  -15.274800   -5.320500
H      17.270100  -18.454500   -3.262200
H      16.565100  -19.964800   -3.831000
C      16.777700  -19.856000   -1.653900
C      -0.687500  -11.963100   -5.389800
H       0.782500  -10.373700   -5.664100
H      16.852700  -19.063500   -0.880500
H      15.915700  -20.486700   -1.354900
C      18.054100  -20.709300   -1.655600
H      -1.543900  -11.297500   -5.319000
H      18.927200  -20.093300   -1.941700
H      17.979800  -21.501800   -2.424400
C      18.278800  -21.336400   -0.271700
H      18.408100  -20.532800    0.481000
H      17.372000  -21.896700    0.031900
C      19.492700  -22.275200   -0.232100
H      20.406000  -21.731700   -0.539300
H      19.366800  -23.091700   -0.968500
C      19.673300  -22.858600    1.177100
H      18.743200  -23.374200    1.487800
H      19.821600  -22.034900    1.903400
C      20.852800  -23.836500    1.264100
H      20.704300  -24.674600    0.556600
H      21.786700  -23.335800    0.945400
C      21.006500  -24.377000    2.693400
H      20.065300  -24.868200    3.009200
H      21.159300  -23.535000    3.397100
C      22.172100  -25.367300    2.814700
H      22.018100  -26.220700    2.127400
H      23.114100  -24.886200    2.489600
C      22.318100  -25.877700    4.256000
H      21.375200  -26.360400    4.580400
H      22.474000  -25.021900    4.942900
C      23.474300  -26.863900    4.402100
H      23.564100  -27.215000    5.436600
H      23.336400  -27.746100    3.767100
H      24.432100  -26.408300    4.126600
C      -2.141500  -13.906900   -5.101100
C      -3.252400  -14.357800   -4.937200
C      -4.549900  -14.894400   -4.741900
C      -5.665100  -14.040900   -4.667300
C      -4.717100  -16.287200   -4.623900
C      -6.947700  -14.581300   -4.467300
H      -5.536600  -12.962100   -4.769100
C      -5.997600  -16.810200   -4.421500
H      -3.853500  -16.951400   -4.699300
C      -8.075300  -13.725000   -4.390300
C      -7.115100  -15.974200   -4.341300
C      -6.166400  -18.302300   -4.350000
C      -9.040200  -12.997700   -4.322000
H      -8.112300  -16.394900   -4.191000
O      -5.972700  -19.036900   -5.311700
N      -6.587300  -18.784000   -3.119200
C     -10.179300  -12.156400   -4.229600
H      -6.498100  -18.221400   -2.262500
C      -6.837100  -20.231500   -2.914000
C     -11.465100  -12.716800   -4.135800
C     -10.038400  -10.757500   -4.220400
C      -5.537300  -21.015600   -2.751700
C      -7.690300  -20.370100   -1.649600
C     -12.564000  -11.849800   -4.026500
H     -11.604900  -13.795100   -4.149600
C     -11.192300   -9.958900   -4.104000
H      -9.052200  -10.291600   -4.303400
H      -5.729200  -22.064900   -2.496800
H      -4.955500  -20.992800   -3.684700
H      -4.904200  -20.585700   -1.958000
O      -8.100100  -19.514600   -0.898100
O      -7.971700  -21.699100   -1.426000
N     -12.443000  -10.500900   -4.004000
H     -13.587300  -12.238500   -3.952000
C     -11.115400   -8.469000   -4.076000
C      -8.695000  -21.997900   -0.180900
N      -9.862100   -7.933700   -4.181700
C     -12.263400   -7.664300   -3.940800
H      -8.206200  -21.423800    0.638600
H      -9.730500  -21.644900   -0.313100
C      -8.573700  -23.507200   -0.017600
C      -9.731300   -6.585900   -4.157700
C     -12.109000   -6.267300   -3.906000
H     -13.253600   -8.123700   -3.864100
H      -7.590900  -23.845900   -0.408300
H      -9.328300  -24.017700   -0.649300
C      -8.733200  -23.914300    1.453200
C     -10.821200   -5.713500   -4.020000
H      -8.707800   -6.203100   -4.249300
C     -13.227200   -5.410100   -3.742000
H      -7.831600  -23.616500    2.026200
H      -9.575000  -23.359900    1.913800
C      -8.978100  -25.422700    1.595700
H     -10.676100   -4.636600   -3.999400
C     -14.159400   -4.654600   -3.585700
H      -8.194800  -25.990500    1.057100
H      -9.934200  -25.691900    1.104200
C      -9.007600  -25.849900    3.070000
C     -15.257800   -3.782300   -3.384500
H      -7.991300  -25.768800    3.502100
H      -9.641700  -25.152700    3.653300
C      -9.530900  -27.283300    3.235900
C     -15.077600   -2.388700   -3.433600
C     -16.532100   -4.321500   -3.126200
H      -8.890500  -27.986500    2.668500
H     -10.540900  -27.369100    2.789100
C      -9.580900  -27.696100    4.713300
C     -16.171800   -1.532800   -3.214700
H     -14.091700   -1.971300   -3.643800
C     -17.608900   -3.458700   -2.905400
H     -16.677700   -5.404000   -3.107500
H     -10.227800  -26.994800    5.277100
H      -8.573300  -27.606500    5.163900
C     -10.097200  -29.131300    4.885300
C     -15.996000   -0.126500   -3.260000
C     -17.445200   -2.070900   -2.945700
C     -18.972300   -4.051000   -2.690300
H     -11.082800  -29.240500    4.392100
H      -9.420400  -29.838000    4.366000
C     -10.213300  -29.511200    6.367500
C     -15.851600    1.075000   -3.293800
H     -18.296500   -1.406900   -2.778900
O     -19.554800   -4.692100   -3.557900
N     -19.547000   -3.780100   -1.459100
H     -10.941700  -28.843200    6.868000
H      -9.244900  -29.338100    6.876900
C     -10.637500  -30.974300    6.554300
C     -15.692100    2.484700   -3.318800
H     -18.981200   -3.487600   -0.652500
C     -20.924000   -4.239000   -1.152800
H     -11.585300  -31.168400    6.016800
H      -9.888800  -31.647300    6.093800
C     -10.801900  -31.319000    8.041300
C     -16.817500    3.325500   -3.269700
C     -14.409800    3.058500   -3.381100
C     -20.988200   -5.739700   -0.885600
C     -21.390000   -3.457000    0.075800
H     -11.579400  -30.670100    8.492300
H      -9.863200  -31.090500    8.585500
C     -11.170700  -32.784300    8.256800
C     -16.613000    4.714600   -3.274300
H     -17.821700    2.910400   -3.229600
C     -14.291900    4.461600   -3.377200
H     -13.515500    2.430800   -3.432700
H     -21.992700   -6.050900   -0.575400
H     -20.721300   -6.301200   -1.793600
H     -20.280800   -6.041600   -0.095400
O     -20.792600   -2.637000    0.737200
O     -22.683800   -3.806600    0.385000
H     -11.293700  -33.005500    9.323800
H     -12.110700  -33.043400    7.757300
H     -10.396700  -33.456900    7.870300
N     -15.383700    5.281600   -3.319900
H     -17.459100    5.412200   -3.237800
C     -12.962300    5.136900   -3.427100
C     -23.222800   -3.199500    1.609900
N     -11.876200    4.310700   -3.510300
C     -12.833700    6.538700   -3.382000
H     -22.449500   -3.305500    2.405100
H     -23.394700   -2.131600    1.398300
C     -24.493500   -3.981900    1.906600
C     -10.643100    4.868400   -3.556900
C     -11.545900    7.101500   -3.417500
H     -13.724000    7.172000   -3.319800
H     -24.321400   -5.064300    1.733500
H     -25.292700   -3.696300    1.192400
C     -24.936900   -3.728300    3.352000
C     -10.427700    6.254300   -3.512500
H      -9.803600    4.166300   -3.628600
C     -11.356200    8.504900   -3.340200
H     -24.198700   -4.170300    4.055400
H     -24.938100   -2.640100    3.561800
C     -26.331900   -4.303700    3.622700
H      -9.421300    6.663600   -3.547800
C     -11.163300    9.697100   -3.256100
H     -26.320600   -5.403800    3.497000
H     -27.052900   -3.923800    2.871100
C     -26.812100   -3.936900    5.032300
C     -10.957200   11.094500   -3.137300
H     -26.065200   -4.286600    5.782900
H     -26.853500   -2.836000    5.143100
C     -28.188000   -4.541100    5.333000
C      -9.669200   11.641600   -3.277000
C     -12.055500   11.933900   -2.871300
H     -28.148400   -5.643200    5.229500
H     -28.923000   -4.196100    4.578100
C     -28.674100   -4.165700    6.738500
C      -9.478500   13.028200   -3.140300
H      -8.819500   10.992600   -3.494500
C     -11.851300   13.310000   -2.733500
H     -13.059800   11.512700   -2.784800
H     -28.749000   -3.065800    6.834300
H     -27.915800   -4.482800    7.492600
C     -30.030500   -4.810900    7.046300
C      -8.182200   13.587900   -3.279700
C     -10.575700   13.867200   -2.862800
C     -13.048700   14.193800   -2.529600
H     -30.778400   -4.487400    6.293800
H     -29.956300   -5.911000    6.940900
C     -30.527500   -4.456900    8.453200
C      -7.080000   14.074700   -3.393900
H     -10.429100   14.945100   -2.761100
O     -13.934700   14.291400   -3.373600
N     -13.069900   14.926600   -1.354500
H     -30.637100   -3.360600    8.553300
H     -29.758000   -4.753200    9.204900
C     -31.862200   -5.147600    8.761300
C      -5.793900   14.664500   -3.509800
H     -12.493100   14.671200   -0.543400
C     -14.170600   15.888500   -1.092800
H     -32.619900   -4.861100    8.004500
H     -31.749700   -6.245300    8.668700
C     -32.376600   -4.796400   10.162900
C      -5.663300   16.062800   -3.580600
C      -4.636100   13.867300   -3.540500
C     -15.481900   15.183900   -0.757800
C     -13.728200   16.772400    0.073900
H     -32.546500   -3.705400   10.242200
H     -31.590500   -5.037000   10.919400
C     -33.663400   -5.546400   10.497800
C      -4.373200   16.609400   -3.666800
H      -6.540700   16.705200   -3.567700
C      -3.378000   14.495700   -3.623100
H      -4.705500   12.776300   -3.502500
H     -16.266500   15.901200   -0.488800
H     -15.834100   14.601400   -1.622900
H     -15.359800   14.483500    0.084300
O     -12.704800   16.735400    0.718400
O     -14.697200   17.715000    0.340400
H     -34.022000   -5.293000   11.502100
H     -34.467000   -5.302800    9.793200
H     -33.519300   -6.632400   10.466000
N      -3.248100   15.854600   -3.680900
H      -4.220700   17.694500   -3.723900
C      -2.109800   13.708900   -3.641400
C     -14.434300   18.551300    1.520100
N      -2.257100   12.349900   -3.654500
C      -0.842100   14.323700   -3.635000
H     -14.245000   17.858800    2.372700
H     -13.526800   19.142800    1.315300
C     -15.686400   19.396300    1.707100
C      -1.143700   11.579100   -3.665200
C       0.304500   13.509700   -3.631400
H      -0.758900   15.414500   -3.633700
H     -16.588100   18.798600    1.457000
H     -15.687800   20.244100    0.992600
C     -15.750000   19.899700    3.153600
C       0.154300   12.111300   -3.651000
H      -1.312800   10.495600   -3.681300
C       1.610200   14.063900   -3.591800
H     -15.852500   19.035200    3.842800
H     -14.792600   20.390500    3.420400
C     -16.901600   20.883000    3.388900
H       1.023900   11.458900   -3.652600
C       2.742200   14.490300   -3.541300
H     -17.867800   20.421700    3.105000
H     -16.788600   21.769300    2.732800
C     -16.932200   21.325500    4.858400
C       4.067000   14.991200   -3.470800
H     -16.918200   20.431100    5.523600
H     -16.007000   21.886200    5.095200
C     -18.158300   22.190100    5.166800
C       5.161800   14.110600   -3.550700
C       4.285100   16.372800   -3.319800
H     -19.080400   21.581500    5.089400
H     -18.255500   22.986600    4.401400
C     -18.070100   22.830400    6.558000
C       6.472400   14.612400   -3.469600
H       4.994000   13.040300   -3.680400
C       5.594500   16.859200   -3.239500
H       3.437000   17.059700   -3.277600
H     -17.126100   23.400000    6.655600
H     -18.021100   22.035000    7.338000
C     -19.265300   23.757000    6.807600
C       7.581200   13.731500   -3.554100
C       6.690600   15.995800   -3.308600
C       5.794300   18.346900   -3.172400
H     -19.289600   24.542900    6.025400
H     -20.210300   23.189600    6.698200
C     -19.213900   24.417500    8.190200
C       8.534700   12.989500   -3.625900
H       7.708900   16.387500   -3.251700
O       5.462300   19.083600   -4.094700
N       6.395500   18.836400   -2.020000
H     -18.280000   25.000500    8.300000
H     -19.170100   23.631300    8.979900
C     -20.427600   25.330200    8.407400
C       9.675200   12.147500   -3.700200
H       6.445100   18.288000   -1.152400
C       6.622700   20.296600   -1.883400
H     -20.419300   26.149800    7.661400
H     -21.363200   24.766800    8.223100
C     -20.454200   25.928900    9.818700
C      10.952000   12.714900   -3.859400
C       9.553800   10.749800   -3.605900
C       5.317500   21.050100   -1.637100
C       7.596900   20.539200   -0.729700
H     -19.555400   26.554800    9.981200
H     -20.390500   25.111300   10.575100
C     -21.712900   26.761000   10.050900
C      12.062300   11.857700   -3.910400
H      11.076200   13.792300   -3.941300
C      10.719600    9.960800   -3.659700
H       8.573700   10.277400   -3.494500
H       5.498100   22.115400   -1.445700
H       4.654400   20.964100   -2.511300
H       4.777700   20.643000   -0.768200
O       8.212800   19.748100   -0.054800
O       7.731600   21.898900   -0.530700
H     -21.751600   27.147400   11.075400
H     -21.756100   27.621900    9.373600
H     -22.623800   26.173400    9.887900
N      11.961900   10.510600   -3.808000
H      13.078300   12.252700   -4.036000
C      10.670000    8.473000   -3.550500
C       8.596900   22.298300    0.586400
N       9.421400    7.922400   -3.467600
C      11.837700    7.685300   -3.527500
H       8.337500   21.656400    1.459700
H       9.635900   22.100100    0.276300
C       8.304900   23.774600    0.829700
C       9.315800    6.576000   -3.365300
C      11.712000    6.289800   -3.410700
H      12.822100    8.156900   -3.602100
H       7.211600   23.953400    0.830500
H       8.701100   24.395600   -0.010600
C       8.931000   24.203500    2.163000
C      10.427800    5.721100   -3.331500
H       8.294400    6.180200   -3.306800
C      12.853300    5.447600   -3.362400
H       8.404500   23.696600    3.000300
H       9.981000   23.850300    2.212300
C       8.900000   25.722400    2.378500
H      10.300700    4.644800   -3.246200
C      13.804800    4.701100   -3.309100
H       7.855900   26.085600    2.408200
H       9.376800   26.250600    1.517600
C       9.632500   26.088900    3.677100
C      14.918000    3.824600   -3.245300
H       9.164500   25.550800    4.532800
H      10.676400   25.719800    3.630500
C       9.637300   27.598200    3.946600
C      14.716400    2.434400   -3.165500
C      16.224800    4.346200   -3.267700
H       8.601700   27.979400    4.018600
H      10.097400   28.140000    3.083900
C      10.414600   27.925700    5.229100
C      15.821700    1.567700   -3.104800
H      13.703400    2.028600   -3.156300
C      17.316900    3.474000   -3.203300
H      16.382300    5.424200   -3.345800
H      11.445700   27.528300    5.152300
H       9.955800   27.395000    6.094000
C      10.464700   29.434000    5.498900
C      15.620500    0.164800   -3.035200
C      17.130500    2.091300   -3.120800
C      18.701400    4.054500   -3.305600
H      10.924400   29.958400    4.624800
H       9.440700   29.843000    5.584600
C      11.268500   29.756900    6.765500
C      15.452400   -1.033000   -2.980700
H      17.990500    1.418300   -3.081300
O      19.109300    4.593200   -4.328000
N      19.488800    3.929500   -2.169200
H      12.249700   29.244400    6.730900
H      10.748600   29.345800    7.656100
C      11.485100   31.267700    6.926300
C      15.295800   -2.442700   -2.917700
H      19.086300    3.692700   -1.250300
C      20.875800    4.458100   -2.150000
H      12.057400   31.658100    6.061200
H      10.514000   31.797600    6.904100
C      12.227300   31.598100    8.229000
C      16.426600   -3.272900   -3.017300
C      14.028500   -3.029900   -2.753500
C      20.900100    5.980700   -2.049700
C      21.599600    3.830900   -0.953900
H      13.156600   30.999000    8.296800
H      11.609000   31.298600    9.099100
C      12.568800   33.083300    8.328000
C      16.244500   -4.662600   -2.944300
H      17.418900   -2.847900   -3.150600
C      13.932400   -4.433900   -2.686900
H      13.128600   -2.412800   -2.681100
H      21.926100    6.357800   -1.946500
H      20.463700    6.430800   -2.954400
H      20.321200    6.340800   -1.187200
O      21.224100    2.966700   -0.196800
O      22.856500    4.386000   -0.824400
H      13.061400   33.313200    9.279600
H      13.245900   33.396500    7.525200
H      11.672500   33.710400    8.263300
N      15.031000   -5.241600   -2.779300
H      17.095800   -5.350800   -3.019600
C      12.623200   -5.129100   -2.509400
C      23.639400    3.915000    0.327600
N      11.520400   -4.322800   -2.460600
C      12.530100   -6.530700   -2.397700
H      22.968500    3.917500    1.216700
H      23.950800    2.881600    0.103100
C      24.804700    4.888200    0.457900
C      10.305200   -4.900500   -2.303600
C      11.262300   -7.114900   -2.230600
H      13.432000   -7.148300   -2.443500
H      24.436300    5.932300    0.414800
H      25.496400    4.789000   -0.414400
C      25.555000    4.625200    1.770100
C      10.126000   -6.286700   -2.184200
H       9.450100   -4.214200   -2.273600
C      11.106400   -8.520100   -2.104900
H      24.894100    4.862200    2.630100
H      25.785900    3.544300    1.857900
C      26.856200    5.431900    1.883300
H       9.133200   -6.711900   -2.059800
C      10.934500   -9.712500   -1.990900
H      26.642400    6.515400    1.821800
H      27.530700    5.211100    1.021700
C      27.576000    5.105300    3.199500
C      10.731100  -11.109800   -1.857100
H      26.922600    5.370200    4.054800
H      27.739800    4.011600    3.270800
C      28.919600    5.832700    3.339700
C       9.429200  -11.620700   -1.704600
C      11.832900  -11.985000   -1.881600
H      28.769400    6.927200    3.284900
H      29.590900    5.580100    2.484200
C      29.604300    5.457300    4.661600
C       9.230800  -13.006400   -1.573100
H       8.573600  -10.943600   -1.693500
C      11.622300  -13.360700   -1.744100
H      12.842900  -11.591300   -2.015800
H      29.719600    4.357100    4.722100
H      28.954200    5.740600    5.513000
C      30.974800    6.126900    4.818500
C       7.919800  -13.527900   -1.429600
C      10.334800  -13.882000   -1.589500
C      12.808500  -14.282400   -1.823800
H      31.641800    5.841800    3.969000
H      30.871800    7.226600    4.756600
C      31.635100    5.735100    6.147400
C       6.803100  -13.980800   -1.312600
H      10.181400  -14.959300   -1.491500
O      13.463700  -14.431500   -2.847400
N      13.093300  -14.966200   -0.649700
H      31.636000    4.633000    6.258000
H      31.033300    6.123200    6.992300
C      33.072500    6.262800    6.246400
C       5.503000  -14.532800   -1.176800
H      12.713800  -14.657400    0.255400
C      14.227300  -15.919300   -0.577100
H      33.691300    5.829100    5.436700
H      33.087900    7.356800    6.080700
C      33.696000    5.934700    7.610700
C       5.334400  -15.927000   -1.111000
C       4.370400  -13.701600   -1.106900
C      15.567000  -15.196600   -0.462100
C      13.999500  -16.805900    0.651900
H      33.651200    4.842900    7.793000
H      33.098500    6.402000    8.418600
C      35.143700    6.411100    7.703200
C       4.033400  -16.437000   -0.975100
H       6.191000  -16.594800   -1.166500
C       3.100600  -14.293800   -0.969700
H       4.468200  -12.613600   -1.161000
H      16.392300  -15.903000   -0.307500
H      15.775700  -14.624300   -1.377500
H      15.570200  -14.486700    0.381000
O      13.056600  -16.842600    1.409300
O      15.078000  -17.644200    0.827300
H      35.569000    6.193500    8.689500
H      35.779000    5.921200    6.956800
H      35.224300    7.492200    7.542800
N       2.934000  -15.649100   -0.903100
H       3.851000  -17.517600   -0.921400
C       1.854900  -13.476400   -0.888100
C      15.051200  -18.475100    2.040200
N       2.015700  -12.123500   -0.999700
C       0.588500  -14.065600   -0.705400
H      14.771700  -17.816600    2.894100
H      14.273500  -19.242000    1.894300
C      16.460800  -19.040800    2.152700
C       0.916200  -11.334900   -0.933900
C      -0.541800  -13.232800   -0.634900
H       0.493500  -15.152500   -0.623000
H      17.200000  -18.263100    1.868500
H      16.599800  -19.857200    1.414600
C      16.731200  -19.545100    3.576500
C      -0.380100  -11.841300   -0.752500
H       1.095000  -10.257000   -1.031000
H      16.804200  -18.685200    4.273500
H      15.873300  -20.148000    3.934900
C      18.011200  -20.390200    3.643600
H      -1.237700  -11.174900   -0.705000
H      18.870400  -19.814600    3.248700
H      17.909600  -21.273100    2.981100
C      18.305700  -20.846600    5.079700
H      18.558800  -19.969300    5.706100
H      17.394500  -21.288900    5.528200
C      19.449100  -21.869600    5.132500
H      20.366600  -21.436100    4.690000
H      19.196000  -22.747000    4.504800
C      19.727600  -22.323200    6.572500
H      18.794000  -22.699900    7.035100
H      20.041000  -21.456200    7.185900
C      20.805700  -23.414500    6.628100
H      20.498200  -24.277100    6.005100
H      21.746400  -23.037700    6.182300
C      21.060500  -23.878600    8.068700
H      20.116000  -24.244400    8.517700
H      21.376700  -23.018000    8.690000
C      22.124400  -24.983000    8.133800
H      21.814500  -25.845500    7.512900
H      23.073300  -24.622500    7.692700
C      22.363700  -25.441400    9.579700
H      21.412100  -25.796400   10.024000
H      22.683500  -24.579900   10.199000
C      23.411100  -26.548800    9.664700
H      23.570600  -26.861200   10.703400
H      23.108300  -27.436600    9.098500
H      24.379100  -26.221400    9.269000
C      -1.836400  -13.780000   -0.441000
C      -2.946600  -14.230100   -0.269600
C      -4.236100  -14.779500   -0.059400
C      -5.370200  -13.949600   -0.018200
C      -4.373800  -16.169300    0.114300
C      -6.641700  -14.510500    0.199800
H      -5.265600  -12.872000   -0.157800
C      -5.642900  -16.712400    0.336600
H      -3.495600  -16.817400    0.066600
C      -7.782500  -13.670000    0.252700
C      -6.780200  -15.901100    0.376700
C      -5.755700  -18.203700    0.482500
C      -8.750100  -12.944900    0.308200
H      -7.769400  -16.338100    0.533100
O      -5.462400  -18.979500   -0.417300
N      -6.196400  -18.633200    1.726800
C      -9.882300  -12.093500    0.390500
H      -6.348200  -17.974000    2.498500
C      -6.411600  -20.072700    2.025800
C     -11.177300  -12.634300    0.463800
C      -9.719700  -10.696600    0.414600
C      -5.131800  -20.891800    1.893700
C      -6.937300  -20.153200    3.462400
C     -12.263900  -11.750500    0.568400
H     -11.335100  -13.710100    0.440600
C     -10.861600   -9.880700    0.527000
H      -8.725000  -10.246500    0.347600
H      -5.299200  -21.941100    2.169700
H      -4.774200  -20.871600    0.848800
H      -4.316200  -20.504000    2.516000
O      -7.004800  -19.248800    4.265500
O      -7.350000  -21.422800    3.757800
N     -12.122000  -10.403900    0.606900
H     -13.293900  -12.124700    0.627200
C     -10.759100   -8.393000    0.577400
C      -7.836600  -21.622300    5.138400
N      -9.493900   -7.878700    0.508500
C     -11.894400   -7.569600    0.700900
H      -7.068800  -21.224600    5.825700
H      -8.766900  -21.038700    5.239900
C      -8.041500  -23.125300    5.265600
C      -9.340000   -6.534000    0.555000
C     -11.716000   -6.176000    0.766700
H     -12.894200   -8.011600    0.744700
H      -7.137400  -23.663700    4.915600
H      -8.859400  -23.460000    4.594800
C      -8.352600  -23.483800    6.725200
C     -10.417400   -5.643900    0.685500
H      -8.307800   -6.168200    0.488800
C     -12.825400   -5.308600    0.939100
H      -7.485600  -23.228500    7.366800
H      -9.195700  -22.866800    7.095400
C      -8.695300  -24.969600    6.890700
H     -10.251700   -4.569800    0.726300
C     -13.757400   -4.556900    1.113400
H      -7.868200  -25.596100    6.503300
H      -9.580500  -25.225200    6.274300
C      -8.966500  -25.315500    8.362500
C     -14.865000   -3.703600    1.345600
H      -8.065100  -25.106800    8.970500
H      -9.761100  -24.658500    8.766100
C      -9.376500  -26.784600    8.524700
C     -14.717700   -2.305900    1.310600
C     -16.120900   -4.271900    1.628100
H      -8.596500  -27.441800    8.091500
H     -10.296800  -26.982500    7.940000
C      -9.607900  -27.158100    9.996100
C     -15.826000   -1.478100    1.566400
H     -13.745800   -1.863200    1.084100
C     -17.213800   -3.437400    1.884500
H     -16.241000   -5.358000    1.637000
H     -10.382100  -26.502200   10.437800
H      -8.687300  -26.975300   10.582400
C     -10.029800  -28.627800   10.126800
C     -15.669500   -0.068400    1.547900
C     -17.083100   -2.046400    1.853300
C     -18.546400   -4.088600    2.120500
H     -10.961300  -28.800000    9.551300
H      -9.262500  -29.278500    9.661500
C     -10.243800  -29.046500   11.587400
C     -15.523400    1.133100    1.545600
H     -17.947000   -1.402800    2.036000
O     -19.092000   -4.778300    1.268600
N     -19.109700   -3.875900    3.372100
H     -11.039800  -28.428200   12.044500
H      -9.329800  -28.845600   12.178300
C     -10.612000  -30.533800   11.686400
C     -15.356700    2.542100    1.566200
H     -18.605100   -3.382400    4.114600
C     -20.443900   -4.433400    3.717400
H     -11.505500  -30.744800   11.067000
H      -9.799400  -31.152100   11.257900
C     -10.877300  -30.961200   13.136600
C     -16.476800    3.389000    1.630300
C     -14.069600    3.109200    1.540900
C     -20.478300   -5.955700    3.626000
C     -20.773700   -3.992800    5.147300
H     -11.706500  -30.361300   13.559900
H      -9.992100  -30.739200   13.763900
C     -11.216200  -32.447600   13.232700
C     -16.262900    4.776000    1.677000
H     -17.484700    2.980500    1.643900
C     -13.941800    4.510200    1.597100
H     -13.179200    2.476700    1.479800
H     -21.436600   -6.356500    3.981000
H     -20.347000   -6.276000    2.576900
H     -19.676400   -6.430500    4.204400
O     -20.030100   -3.464300    5.942100
O     -22.082800   -4.270700    5.437900
H     -11.415500  -32.742200   14.269000
H     -12.106100  -32.698300   12.644300
H     -10.394600  -33.073600   12.866700
N     -15.029200    5.335700    1.667800
H     -17.105600    5.477300    1.727000
C     -12.606700    5.177000    1.592700
C     -22.530800   -3.911700    6.798000
N     -11.523900    4.343300    1.553200
C     -12.470200    6.577900    1.636000
H     -21.723700   -4.168300    7.508800
H     -22.688800   -2.820500    6.790000
C     -23.806900   -4.710500    7.029300
C     -10.285700    4.892300    1.551500
C     -11.177500    7.132100    1.644900
H     -13.357100    7.217700    1.662500
H     -23.608600   -5.793900    6.909900
H     -24.570900   -4.465700    6.251600
C     -24.357100   -4.406700    8.429400
C     -10.062500    6.277200    1.598000
H      -9.448300    4.184300    1.514500
C     -10.984300    8.536100    1.716400
H     -23.609300   -4.696400    9.195100
H     -24.501800   -3.313700    8.546100
C     -25.681200   -5.128900    8.711500
H      -9.052000    6.678900    1.599800
C     -10.793100    9.728400    1.793900
H     -25.548900   -6.222700    8.611500
H     -26.449300   -4.847400    7.952400
C     -26.199900   -4.784500   10.114900
C     -10.595300   11.128000    1.903300
H     -25.448600   -5.077300   10.874500
H     -26.313100   -3.686800   10.212600
C     -27.537300   -5.469600   10.423500
C      -9.301800   11.676900    1.843300
C     -11.709000   11.968400    2.085700
H     -27.430900   -6.567500   10.336800
H     -28.304600   -5.180200    9.666300
C     -28.040600   -5.098600   11.825600
C      -9.124100   13.066600    1.968900
H      -8.437500   11.026000    1.698600
C     -11.517600   13.347500    2.216500
H     -12.715300   11.544200    2.117600
H     -28.121500   -3.997700   11.915300
H     -27.299100   -5.408400   12.587100
C     -29.397700   -5.745200   12.128500
C      -7.819800   13.622200    1.919500
C     -10.239000   13.908200    2.154700
C     -12.735900   14.212400    2.378300
H     -30.142600   -5.453500   11.349500
H     -29.316200   -6.846600   12.064200
C     -29.925400   -5.338500   13.511000
C      -6.707200   14.097500    1.887800
H     -10.102000   14.988600    2.239400
O     -13.587300   14.327600    1.508600
N     -12.836500   14.852700    3.608200
H     -29.898700   -4.236600   13.616600
H     -29.258500   -5.732500   14.301400
C     -31.357400   -5.845400   13.728600
C      -5.408200   14.669600    1.864200
H     -12.165600   14.674100    4.363200
C     -13.983100   15.741500    3.927800
H     -32.021000   -5.448600   12.933800
H     -31.389900   -6.946400   13.621400
C     -31.901800   -5.440200   15.105100
C      -5.252300   16.066800    1.871900
C      -4.263700   13.852800    1.844000
C     -15.315200   14.997900    3.915600
C     -13.729900   16.322200    5.323200
H     -31.810200   -4.344700   15.240100
H     -31.283500   -5.895700   15.903000
C     -33.361000   -5.858600   15.277700
C      -3.950500   16.594000    1.866400
H      -6.118600   16.724600    1.881500
C      -2.993400   14.460800    1.842300
H      -4.352900   12.762600    1.830400
H     -16.140300   15.653100    4.224800
H     -15.538500   14.634000    2.897500
H     -15.314000   14.121500    4.575100
O     -12.876800   15.982700    6.110500
O     -14.622600   17.323600    5.593000
H     -33.734300   -5.592400   16.273000
H     -34.010100   -5.369800   14.542900
H     -33.487400   -6.940500   15.158000
N      -2.839000   15.819200    1.856100
H      -3.778400   17.677300    1.872200
C      -1.737500   13.655100    1.831400
C     -14.494500   17.958100    6.919900
N      -1.900300   12.297700    1.859400
C      -0.463200   14.254200    1.799300
H     -14.263100   17.171400    7.662000
H     -13.646400   18.658500    6.841100
C     -15.830600   18.644000    7.174400
C      -0.796000   11.514000    1.850300
C       0.673500   13.427100    1.796700
H      -0.366900   15.343700    1.776700
H     -16.651800   17.900700    7.165600
H     -16.072400   19.354000    6.347100
C     -15.776900   19.381300    8.519600
C       0.508600   12.030800    1.820000
H      -0.976300   10.431900    1.870600
C       1.982300   13.975500    1.779000
H     -15.556800   18.659600    9.332600
H     -14.934000   20.101600    8.518600
C     -17.082100   20.121800    8.838000
H       1.371400   11.367900    1.815600
C       3.110700   14.410200    1.771900
H     -17.926200   19.408100    8.882300
H     -17.334500   20.835100    8.017200
C     -16.965000   20.884800   10.165100
C       4.429400   14.933600    1.772300
H     -16.754000   20.173200   10.987700
H     -16.093700   21.568100   10.129300
C     -18.232600   21.685200   10.490000
C       5.538400   14.068800    1.751400
C       4.623200   16.327100    1.799000
H     -19.107500   21.009700   10.538900
H     -18.457200   22.407500    9.669600
C     -18.080600   22.444400   11.815900
C       6.840900   14.599200    1.756900
H       5.389100   12.987700    1.729100
C       5.923800   16.841300    1.813800
H       3.762400   16.999600    1.801200
H     -17.178000   23.085200   11.780000
H     -17.906000   21.726000   12.640500
C     -19.313200   23.301300   12.128900
C       7.960200   13.728200    1.735500
C       7.035200   15.994700    1.788800
C       6.089900   18.335800    1.815400
H     -19.503200   24.020700   11.297700
H     -20.215800   22.663000   12.177700
C     -19.145400   24.070200   13.446500
C       8.915100   12.984400    1.720400
H       8.047000   16.406400    1.785500
O       5.751900   19.043500    0.876900
N       6.632600   18.850900    2.986300
H     -18.180100   24.612500   13.449500
H     -19.091500   23.356700   14.291400
C     -20.295400   25.061900   13.669000
C      10.051100   12.132400    1.710000
H       6.831700   18.248000    3.793200
C       6.856500   20.308100    3.173800
H     -20.292500   25.828800   12.869900
H     -21.267900   24.540900   13.580700
C     -20.195000   25.744200   15.040600
C      11.342000   12.685400    1.651000
C       9.905900   10.734800    1.765400
C       5.552100   21.099200    3.157200
C       7.549000   20.480700    4.530200
H     -19.218000   26.257200   15.135500
H     -20.215100   24.981000   15.843000
C     -21.326000   26.747700   15.256000
C      12.442800   11.814100    1.656100
H      11.486000   13.762500    1.602600
C      11.062500    9.931000    1.768200
H       8.914800   10.273700    1.806400
H       5.730600   22.164200    3.355500
H       5.070100   21.017900    2.167600
H       4.829300   20.734700    3.897400
O       7.732400   19.619500    5.362600
O       7.960400   21.772600    4.713600
H     -21.257700   27.214100   16.245300
H     -21.299600   27.551700   14.512000
H     -22.309700   26.269500   15.186400
N      12.319000   10.466500    1.716800
H      13.469900   12.198400    1.611200
C      10.986200    8.442000    1.831600
C       8.643500   22.043100    5.995700
N       9.730500    7.912200    1.940600
C      12.137600    7.632300    1.785300
H       8.134900   21.465200    6.790500
H       9.676000   21.676300    5.870700
C       8.552700   23.548500    6.207800
C       9.601000    6.565200    1.999600
C      11.986800    6.235800    1.853100
H      13.128700    8.087100    1.698400
H       7.492700   23.869900    6.231600
H       9.002700   24.099100    5.349000
C       9.262000   23.914900    7.519200
C      10.696200    5.688300    1.959200
H       8.574500    6.187100    2.083500
C      13.114900    5.375900    1.822600
H       8.762300   23.403600    8.367400
H      10.301000   23.528200    7.505100
C       9.285300   25.426500    7.780300
H      10.550600    4.611800    2.009700
C      14.061200    4.621200    1.805000
H       8.253500   25.824600    7.816800
H       9.780700   25.962100    6.938800
C      10.013900   25.733600    9.097300
C      15.176400    3.745900    1.792700
H       9.457300   25.286000    9.944300
H      11.008000   25.244900    9.100600
C      10.182200   27.240300    9.330000
C      14.987100    2.353700    1.847600
C      16.477700    4.278600    1.734300
H       9.194600   27.739800    9.313500
H      10.759700   27.694700    8.497100
C      10.885400   27.519900   10.666200
C      16.100800    1.494500    1.844200
H      13.978100    1.939300    1.893000
C      17.576600    3.412800    1.741900
H      16.625300    5.359100    1.679600
H      11.833600   26.950900   10.722400
H      10.262300   27.146900   11.502100
C      11.168200   29.016600   10.852900
C      15.913900    0.090200    1.905300
C      17.404000    2.027200    1.791100
C      18.954200    4.013100    1.677400
H      11.836300   29.375900   10.045000
H      10.229100   29.593600   10.747600
C      11.804400   29.304800   12.219700
C      15.758000   -1.108400    1.964300
H      18.267900    1.358900    1.782900
O      19.382000    4.615900    0.703500
N      19.688900    3.845300    2.845000
H      12.739600   28.723000   12.331000
H      11.133800   28.954000   13.027700
C      12.096900   30.800800   12.399100
C      15.586400   -2.514900    2.041900
H      19.271400    3.406400    3.675000
C      21.064200    4.383600    3.004900
H      12.784300   31.150500   11.604800
H      11.166400   31.386200   12.268600
C      12.704100   31.093900   13.778500
C      16.703800   -3.367100    2.009800
C      14.300600   -3.072800    2.159400
C      21.093900    5.908400    2.952600
C      21.561900    3.903200    4.373000
H      13.639800   30.515800   13.908700
H      12.018500   30.741900   14.574100
C      12.988300   32.582500   13.968000
C      16.489900   -4.751500    2.104000
H      17.709800   -2.964800    1.914100
C      14.173500   -4.471600    2.250300
H      13.411700   -2.435800    2.180800
H      22.108600    6.293200    3.119900
H      20.759600    6.261400    1.961900
H      20.432500    6.368800    3.696700
O      20.908900    3.335800    5.221200
O      22.883700    4.201600    4.553200
H      13.414800   32.781600   14.957600
H      13.700000   32.956400   13.223400
H      12.075200   33.182100   13.878700
N      15.258700   -5.302800    2.226700
H      17.329900   -5.457600    2.082400
C      12.842700   -5.132500    2.382600
C      23.441500    3.820300    5.868200
N      11.764500   -4.298200    2.486700
C      12.708500   -6.533700    2.404100
H      22.752300    4.190300    6.648500
H      23.476000    2.718200    5.892800
C      24.815200    4.475100    5.916100
C      10.532700   -4.847900    2.609500
C      11.423600   -7.088100    2.542300
H      13.591100   -7.174300    2.317000
H      24.726000    5.562400    5.718900
H      25.456300    4.079600    5.102300
C      25.460900    4.224000    7.286000
C      10.312200   -6.233800    2.643400
H       9.698000   -4.139900    2.685600
C      11.246600   -8.493900    2.597800
H      24.838800    4.675800    8.084600
H      25.483100    3.136400    7.498800
C      26.885000    4.789500    7.363000
H       9.307800   -6.637000    2.748700
C      11.087500   -9.691400    2.666000
H      26.874100    5.877200    7.156500
H      27.515900    4.336800    6.572800
C      27.507500    4.526000    8.742200
C      10.928800  -11.095500    2.769800
H      26.895400    5.006700    9.530000
H      27.485200    3.441200    8.964400
C      28.951000    5.040900    8.821100
C       9.646400  -11.667200    2.839000
C      12.071900  -11.915400    2.824900
H      28.976100    6.126500    8.604300
H      29.565600    4.560400    8.034800
C      29.567400    4.771600   10.201100
C       9.508900  -13.061000    2.966000
H       8.759600  -11.031800    2.797100
C      11.919000  -13.298200    2.959600
H      13.067700  -11.471200    2.760500
H      29.533000    3.687700   10.424500
H      28.959700    5.260400   10.986900
C      31.016500    5.271600   10.278700
C       8.218900  -13.640200    3.059700
C      10.651100  -13.882600    3.023300
C      13.154800  -14.151100    3.013300
H      31.625300    4.782100    9.493500
H      31.053100    6.356100   10.058600
C      31.631900    4.999800   11.658500
C       7.118900  -14.135300    3.158500
H      10.542300  -14.966300    3.112000
O      13.942900  -14.247600    2.082700
N      13.334100  -14.810700    4.222200
H      31.601400    3.914800   11.876400
H      31.020300    5.482200   12.445400
C      33.078000    5.507500   11.740400
C       5.832800  -14.717800    3.294400
H      12.711300  -14.638400    5.020400
C      14.483700  -15.719900    4.460300
H      33.691400    5.033800   10.950000
H      33.109400    6.594300   11.532300
C      33.695500    5.225300   13.117600
C       5.690100  -16.114600    3.360100
C       4.689800  -13.904200    3.380300
C      15.824000  -14.999100    4.357100
C      14.306700  -16.296100    5.869200
H      33.671600    4.137800   13.325900
H      33.081700    5.698000   13.909300
C      35.132200    5.735200   13.208400
C       4.400200  -16.644500    3.520300
H       6.556500  -16.768000    3.290800
C       3.432200  -14.515900    3.543000
H       4.768800  -12.814500    3.326500
H      16.657700  -15.666600    4.610600
H      15.982000  -14.640100    3.324700
H      15.882900  -14.120900    5.011700
O      13.507600  -15.942500    6.707100
O      15.194600  -17.311700    6.089700
H      35.563000    5.531400   14.195100
H      35.778700    5.257300   12.463900
H      35.187100    6.817200   13.043700
N       3.290300  -15.873700    3.615700
H       4.235900  -17.727800    3.578600
C       2.178700  -13.716100    3.649800
C      15.148700  -17.911000    7.439300
N       2.331600  -12.358900    3.717400
C       0.909200  -14.326000    3.681000
H      15.260900  -17.092400    8.171800
H      14.158000  -18.382000    7.554100
C      16.303500  -18.902700    7.454300
C       1.220100  -11.591300    3.814600
C      -0.225600  -13.516900    3.786600
H       0.822500  -15.414000    3.625300
H      17.233800  -18.405000    7.111900
H      16.118000  -19.715000    6.722800
C      16.485400  -19.474900    8.866600
C      -0.078400  -12.130100    3.854600
H       1.387900  -10.509000    3.861800
H      -1.217700  -13.968100    3.816100
H      16.721300  -18.657200    9.576600
H      15.533900  -19.918900    9.220800
C      17.595100  -20.533400    8.912700
H      -0.944100  -11.478300    3.937900
H      18.544500  -20.104000    8.538200
H      17.350900  -21.368100    8.226000
C      17.792700  -21.068900   10.338700
H      18.047400  -20.236500   11.022000
H      16.841500  -21.490300   10.718300
C      18.891900  -22.138100   10.390600
H      19.841200  -21.719500   10.002800
H      18.634500  -22.977400    9.715000
C      19.100600  -22.665500   11.817300
H      18.156300  -23.095900   12.202500
H      19.349300  -21.827900   12.497100
C      20.213000  -23.721800   11.864600
H      19.966600  -24.557800   11.180600
H      21.158000  -23.288100   11.482800
C      20.427400  -24.260400   13.285700
H      19.492600  -24.720000   13.660000
H      20.649500  -23.424200   13.976400
C      21.567600  -25.287000   13.329400
H      21.353200  -26.121900   12.634500
H      22.505300  -24.826700   12.962400
C      21.780400  -25.834500   14.747800
H      20.847800  -26.306800   15.113700
H      21.990500  -25.000800   15.446200
C      22.923400  -26.846200   14.795100
H      23.066500  -27.235600   15.809300
H      22.731600  -27.702900   14.139200
H      23.872400  -26.397900   14.479600
H      -7.430600  -20.628900   -3.798900
H     -21.600400   -3.969100   -2.026900
H     -14.302700   16.546800   -2.011100
H       7.115600   20.663700   -2.848600
H      21.405900    4.122400   -3.103400
H      14.213300  -16.577300   -1.507600
H      -7.202700  -20.479600    1.311800
H     -21.216000   -3.986300    3.007000
H     -14.010400   16.589800    3.165800
H       7.544200   20.682400    2.344900
H      21.726900    3.959400    2.181000
H      14.445600  -16.567700    3.698500

1460
poly(1-2) s-trans 18-mer right-handed PM7 optimized
N      14.036100   -9.421100   -7.983900
C      14.313600  -10.745000   -8.047600
C      13.323400  -11.730700   -8.179100
C      11.979100  -11.323500   -8.246200
C      11.674500   -9.952400   -8.172700
C      12.728400   -9.026900   -8.045400
N      11.190500   -7.155600   -8.164200
C      10.914800   -5.830200   -8.131100
C      11.896700   -4.848100   -7.928100
C      13.228600   -5.261300   -7.748300
C      13.529200   -6.635200   -7.769100
C      12.484900   -7.555500   -7.984100
H      15.376400  -11.013000   -7.995500
H      13.588600  -12.783500   -8.236400
H      10.638800   -9.603900   -8.221300
H       9.862800   -5.556300   -8.281200
H      11.636200   -3.793200   -7.917700
H      14.555500   -6.988000   -7.628700
C      10.953200  -12.291800   -8.400600
C      10.092500  -13.130000   -8.547500
C       9.065300  -14.090800   -8.731800
C       7.736400  -13.655200   -8.883200
C       9.368000  -15.465900   -8.773900
C       6.711000  -14.595500   -9.074500
H       7.503500  -12.589700   -8.857200
C       8.335700  -16.390000   -8.963400
H      10.399100  -15.803500   -8.666000
C       7.010800  -15.969700   -9.111400
C       5.368300  -14.163400   -9.236000
C       8.644200  -17.862200   -9.049900
H       6.212600  -16.700200   -9.259200
C       4.225900  -13.803400   -9.378900
O       9.084200  -18.409600  -10.045000
N       8.307600  -18.567800   -7.894000
H       3.245800  -13.498400   -9.502100
H       8.149300  -18.071200   -7.000200
C       8.621100  -20.011900   -7.773000
C       7.791200  -20.561500   -6.608200
O       6.928800  -20.021500   -5.953200
O       8.156400  -21.862500   -6.342700
C       7.484900  -22.478300   -5.188900
H       6.404200  -22.508500   -5.407600
H       7.669300  -21.820400   -4.313500
C       8.118100  -23.857900   -5.053400
H       7.752800  -24.526800   -5.857000
H       9.214000  -23.787700   -5.208300
C       7.799200  -24.434200   -3.668700
H       6.718600  -24.311200   -3.452300
H       8.329800  -23.843100   -2.893400
C       8.173800  -25.917700   -3.544100
H       7.629100  -26.512200   -4.302700
H       9.248500  -26.063900   -3.761900
C       7.842400  -26.428800   -2.135600
H       6.786000  -26.190500   -1.896200
H       8.456400  -25.882400   -1.391500
C       8.066700  -27.938400   -1.972800
H       7.470300  -28.496600   -2.719400
H       9.122900  -28.194800   -2.178000
C       7.678500  -28.375500   -0.553400
H       8.276500  -27.806400    0.186600
H       6.620600  -28.107300   -0.361000
C       7.875900  -29.878400   -0.316500
H       8.942300  -30.145900   -0.440700
H       7.328700  -30.463500   -1.079800
C       7.390100  -30.264200    1.087600
H       7.842900  -29.583900    1.840700
H       6.296800  -30.102100    1.161000
C       7.721900  -31.719800    1.436700
H       8.814800  -31.885100    1.378700
H       7.276900  -32.402400    0.687700
C       7.211300  -32.080800    2.839200
H       7.582100  -31.330700    3.577100
H       6.107100  -32.004900    2.867700
C       7.642200  -33.483200    3.258800
H       7.288700  -33.723900    4.267800
H       8.733100  -33.588200    3.259400
H       7.240400  -34.246700    2.582300
C      14.247900   -4.290600   -7.570900
C      15.101400   -3.441700   -7.442500
C      16.106800   -2.448900   -7.318800
C      15.751600   -1.090200   -7.248000
C      17.462600   -2.827600   -7.290400
C      16.755100   -0.108400   -7.159500
H      14.701400   -0.796900   -7.270900
C      18.451600   -1.842400   -7.206400
H      17.737000   -3.883500   -7.341200
C      16.406300    1.266200   -7.111800
C      18.112400   -0.488300   -7.141100
C      19.905300   -2.243300   -7.236300
C      16.121100    2.442700   -7.087800
H      18.892500    0.273600   -7.086000
O      20.638500   -2.056900   -8.189500
N      20.320700   -2.926000   -6.086700
C      15.843100    3.835200   -7.074100
H      19.780300   -2.815200   -5.213100
C      21.757900   -3.248300   -5.882600
C      16.912000    4.750100   -7.037800
C      14.525900    4.326100   -7.108200
C      21.840600   -4.128100   -4.630400
C      16.619300    6.121500   -7.045400
H      17.941400    4.400300   -7.011800
C      14.317400    5.719800   -7.118800
H      13.672500    3.642800   -7.134100
O      20.941900   -4.534100   -3.926200
O      23.149000   -4.426500   -4.331700
N      15.355800    6.608400   -7.088100
H      17.419200    6.872400   -7.022200
C      12.950000    6.316800   -7.179200
C      23.347300   -5.174900   -3.078800
N      11.921800    5.433000   -7.350500
C      12.733300    7.706200   -7.081500
H      22.860800   -6.157200   -3.198900
H      22.839900   -4.604800   -2.272900
C      24.858300   -5.260700   -2.899300
C      10.659400    5.918000   -7.423500
C      11.418500    8.195700   -7.169500
H      13.578700    8.388300   -6.947300
H      25.275500   -6.053800   -3.549900
H      25.333800   -4.320200   -3.246200
C      25.193300   -5.524200   -1.424700
C      10.358700    7.286000   -7.339400
H       9.867600    5.171400   -7.560800
H      24.491300   -6.275400   -1.009200
H      25.024200   -4.598400   -0.838100
C      26.633500   -6.016200   -1.226500
H       9.331800    7.636200   -7.411400
H      26.784200   -6.967000   -1.774000
H      27.349700   -5.297700   -1.668200
C      26.939800   -6.214400    0.265400
H      26.130300   -6.808200    0.735700
H      26.935900   -5.233200    0.779100
C      28.285600   -6.915100    0.498600
H      28.304200   -7.885700   -0.033400
H      29.106500   -6.316000    0.060700
C      28.535700   -7.135500    1.997300
H      28.541600   -6.159800    2.521500
H      27.695600   -7.710400    2.435300
C      29.854800   -7.874200    2.262600
H      30.700700   -7.307100    1.829400
H      29.850500   -8.852000    1.744100
C      30.078500   -8.079600    3.767100
H      30.098200   -7.097100    4.279100
H      29.220800   -8.630100    4.201600
C      31.379600   -8.838700    4.060400
H      32.242900   -8.291600    3.637100
H      31.368200   -9.822200    3.553500
C      31.574400   -9.033400    5.570700
H      31.572400   -8.047300    6.078400
H      30.713100   -9.592400    5.988400
C      32.869100   -9.771300    5.899300
H      32.975800   -9.912400    6.981500
H      33.749500   -9.219000    5.552100
H      32.899600  -10.763200    5.434500
C      11.134100    9.585200   -7.109400
C      10.843000   10.760000   -7.083800
C      10.484500   12.132700   -7.079200
C       9.125800   12.498100   -7.116900
C      11.482600   13.125800   -7.061700
C       8.765900   13.856600   -7.144200
H       8.353300   11.728500   -7.134700
C      11.112500   14.473900   -7.093300
H      12.536600   12.842300   -7.033400
C       7.398900   14.235600   -7.202600
C       9.766000   14.849500   -7.134100
C      12.170600   15.547000   -7.146200
C       6.237800   14.572800   -7.264900
H       9.490000   15.905500   -7.170200
O      12.359600   16.253800   -8.118600
N      12.974200   15.612000   -5.999300
C       4.892900   15.020300   -7.355200
H      12.614500   15.217500   -5.117200
C      13.933900   16.736500   -5.822900
C       4.628700   16.399200   -7.448800
C       3.814200   14.117500   -7.365100
C      14.672100   16.484700   -4.503900
C       3.294300   16.819900   -7.553800
H       5.441400   17.121900   -7.448700
C       2.502800   14.621800   -7.478400
H       3.983700   13.039700   -7.294800
O      14.519800   15.574600   -3.718100
O      15.582000   17.482100   -4.251500
N       2.246800   15.960700   -7.571400
H       3.040000   17.884200   -7.634400
C       1.310000   13.724000   -7.519100
C      16.270600   17.383300   -2.952200
N       1.577300   12.384300   -7.568500
C      -0.006900   14.225000   -7.520600
H      16.876300   16.461800   -2.969200
H      15.487700   17.301700   -2.170700
C      17.101800   18.656000   -2.837400
C       0.534400   11.520000   -7.616700
C      -1.078200   13.315700   -7.586200
H      -0.186600   15.303900   -7.478800
H      18.001900   18.588500   -3.478500
H      16.524900   19.518400   -3.229800
C      17.488500   18.883900   -1.369600
C      -0.804500   11.937000   -7.630600
H       0.796700   10.455600   -7.650400
C      -2.427400   13.754500   -7.629300
H      17.818500   17.926500   -0.917200
H      16.587300   19.193000   -0.800900
C      18.599100   19.930200   -1.199200
H      -1.613400   11.211900   -7.683500
C      -3.591200   14.082600   -7.691100
H      19.507800   19.611000   -1.745000
H      18.294900   20.890800   -1.655600
C      18.926000   20.129800    0.288200
C      -4.952000   14.472300   -7.787600
H      19.145500   19.147100    0.751900
H      18.035000   20.527300    0.813400
C      20.117100   21.071900    0.513900
C      -5.967600   13.499300   -7.807400
C      -5.281800   15.837200   -7.887100
H      21.005800   20.695700   -0.027600
H      19.901600   22.068900    0.085300
C      20.430400   21.200300    2.011800
C      -7.312500   13.891300   -7.932300
H      -5.712500   12.441400   -7.735100
C      -6.622300   16.214700   -8.014000
H      -4.493400   16.593200   -7.875300
H      19.561000   21.645000    2.535500
H      20.568500   20.192600    2.451700
C      21.681700   22.048500    2.278800
C      -8.340600   12.913400   -7.972100
C      -7.640700   15.258900   -8.036800
C      -6.946000   17.676400   -8.191900
H      21.557500   23.055700    1.837600
H      22.559200   21.602100    1.773700
C      21.951400   22.165300    3.785200
C      -9.223700   12.086000   -8.020700
H      -8.683100   15.562500   -8.146300
O      -7.047700   18.218300   -9.278200
N      -7.054400   18.381900   -6.994900
H      21.082000   22.641800    4.280900
H      22.037900   21.153800    4.229200
C      23.222500   22.969900    4.089300
C     -10.291700   11.152700   -8.097900
H      -7.161500   17.897000   -6.091200
C      -7.411600   19.821000   -6.988700
H      23.162900   23.968500    3.617000
H      24.103600   22.474900    3.639500
C      23.422900   23.121200    5.603500
C     -11.604300   11.620100   -8.295100
C     -10.069300    9.768300   -7.993300
C      -6.861400   20.416300   -5.687000
H      22.536800   23.623000    6.044100
H      23.474300   22.119200    6.075900
C      24.677700   23.914200    5.956600
C     -12.643200   10.680800   -8.381000
H     -11.808300   12.684400   -8.385700
C     -11.167600    8.890300   -8.093900
H      -9.061500    9.371100   -7.843400
O      -6.180900   19.895100   -4.832000
O      -7.262500   21.727600   -5.557300
H      24.807400   23.978600    7.043900
H      24.629400   24.938800    5.571700
H      25.580600   23.449200    5.546200
N     -12.442700    9.344400   -8.284800
H     -13.682000   10.997300   -8.537600
C     -11.008100    7.407600   -8.010000
C      -6.904500   22.367300   -4.282300
N      -9.720200    6.952100   -7.964800
C     -12.112100    6.532200   -7.989100
H      -5.807000   22.468700   -4.259100
H      -7.233200   21.683100   -3.469000
C      -7.640500   23.702000   -4.278600
C      -9.510900    5.615100   -7.896500
C     -11.879300    5.146300   -7.924900
H     -13.131300    6.928200   -8.028000
H      -7.133700   24.418300   -4.954300
H      -8.658000   23.573700   -4.700900
C      -7.710800   24.250400   -2.846800
C     -10.553800    4.677100   -7.875300
H      -8.461900    5.297000   -7.861500
H      -6.718800   24.154500   -2.360400
H      -8.400000   23.623900   -2.244200
C      -8.157600   25.718300   -2.797500
H     -10.343900    3.611300   -7.827600
H      -7.433100   26.350700   -3.346100
H      -9.123300   25.844500   -3.322500
C      -8.281600   26.197000   -1.343100
H      -7.372100   25.908500   -0.777800
H      -9.123100   25.671200   -0.850600
C      -8.486800   27.714600   -1.235800
H      -7.662900   28.245900   -1.750300
H      -9.412400   28.011100   -1.764500
C      -8.553600   28.153500    0.234500
H      -9.382400   27.624300    0.744300
H      -7.626300   27.844000    0.756800
C      -8.740400   29.669400    0.385400
H      -9.675100   29.988300   -0.113700
H      -7.923600   30.205700   -0.134500
C      -8.772700   30.074700    1.866100
H      -9.585900   29.530800    2.385100
H      -7.833100   29.757600    2.361600
C      -8.966400   31.586800    2.043600
H      -9.900800   31.911900    1.548000
H      -8.150600   32.135500    1.535600
C      -9.003700   31.969400    3.530100
H      -9.827900   31.429100    4.037200
H      -8.069100   31.632000    4.022600
C      -9.172600   33.471900    3.738700
H      -9.182200   33.721800    4.806200
H     -10.110300   33.838500    3.306300
H      -8.354600   34.037600    3.278700
C     -12.944400    4.208100   -7.920400
C     -13.816900    3.368600   -7.926400
C     -14.841700    2.386700   -7.951000
C     -14.516300    1.020800   -7.863600
C     -16.185700    2.782800   -8.081500
C     -15.534500    0.052300   -7.908500
H     -13.474100    0.712700   -7.767700
C     -17.190700    1.810800   -8.125500
H     -16.439600    3.842500   -8.159700
C     -15.208700   -1.328600   -7.837300
C     -16.880900    0.450900   -8.038900
C     -18.610600    2.263400   -8.341700
C     -14.937000   -2.507800   -7.788100
H     -17.671000   -0.300400   -8.081600
O     -19.084100    2.484500   -9.446700
N     -19.341200    2.465700   -7.176600
C     -14.656700   -3.899800   -7.747600
H     -19.001000    2.170100   -6.247600
C     -20.747200    2.928600   -7.236700
C     -15.701900   -4.825200   -7.925600
C     -13.350900   -4.379500   -7.539800
C     -21.006600    3.780500   -5.988500
C     -15.397700   -6.195000   -7.887900
H     -16.720900   -4.486000   -8.094200
C     -13.129000   -5.771700   -7.519800
H     -12.515000   -3.688300   -7.401300
O     -20.224400    4.196600   -5.165300
O     -22.350000    4.072000   -5.883900
N     -14.144100   -6.669500   -7.691600
H     -16.177200   -6.955900   -8.020100
C     -11.768900   -6.354200   -7.316200
C     -22.729500    4.847200   -4.693800
N     -10.740100   -5.454700   -7.284000
C     -11.556300   -7.739800   -7.172700
H     -22.254000    5.838700   -4.779400
H     -22.321500    4.313600   -3.808300
C     -24.252500    4.901500   -4.718700
C      -9.480400   -5.921800   -7.106700
C     -10.242800   -8.210300   -6.993000
H     -12.401600   -8.434000   -7.205400
H     -24.595100    5.580900   -5.523600
H     -24.662600    3.905900   -4.983600
C     -24.774700    5.359800   -3.350500
C      -9.183900   -7.284500   -6.956900
H      -8.688500   -5.163400   -7.088700
C      -9.953500   -9.593400   -6.855600
H     -24.206100    6.249100   -3.012100
H     -24.574300    4.571300   -2.596000
C     -26.272600    5.696200   -3.373400
H      -8.158600   -7.619000   -6.820200
C      -9.651300  -10.760600   -6.743600
H     -26.464700    6.515600   -4.092600
H     -26.855600    4.830800   -3.741200
C     -26.752800    6.099900   -1.971700
C      -9.306700  -12.132600   -6.629900
H     -26.093800    6.895400   -1.569900
H     -26.649300    5.237700   -1.284200
C     -28.205900    6.595000   -1.958400
C      -7.965000  -12.516800   -6.445600
C     -10.312700  -13.111900   -6.719300
H     -28.316800    7.463700   -2.635400
H     -28.879200    5.813700   -2.359300
C     -28.631900    6.979400   -0.533700
C      -7.632000  -13.880200   -6.353700
H      -7.184000  -11.758200   -6.381700
C      -9.969200  -14.465100   -6.628500
H     -11.353600  -12.815600   -6.869000
H     -28.542900    6.098200    0.131500
H     -27.933000    7.738000   -0.128700
C     -30.066000    7.523600   -0.477200
C      -6.277700  -14.276200   -6.186900
C      -8.641400  -14.859600   -6.444000
C     -11.059600  -15.489600   -6.805000
H     -30.771600    6.775400   -0.885600
H     -30.159600    8.413000   -1.129300
C     -30.459000    7.886500    0.962500
C      -5.125700  -14.627000   -6.057100
H      -8.383000  -15.917900   -6.381500
O     -11.437600  -15.888500   -7.893700
N     -11.649700  -15.913200   -5.619200
H     -30.370400    6.993200    1.611400
H     -29.744700    8.629800    1.368100
C     -31.885600    8.445100    1.047900
C      -3.789100  -15.087300   -5.918000
H     -11.261300  -15.683000   -4.690500
C     -12.758100  -16.895300   -5.634200
H     -32.605800    7.710000    0.640900
H     -31.980000    9.343700    0.408600
C     -32.260900    8.794800    2.495700
C      -3.530000  -16.469800   -5.915500
C      -2.711000  -14.192700   -5.790200
C     -13.665300  -16.577700   -4.440300
H     -32.173000    7.893600    3.134700
H     -31.538600    9.529400    2.904000
C     -33.676200    9.358100    2.599100
C      -2.201000  -16.902900   -5.786400
H      -4.340800  -17.187800   -6.016200
C      -1.404200  -14.708600   -5.668200
H      -2.877200  -13.111800   -5.790000
O     -13.627500  -15.645300   -3.670900
O     -14.635500  -17.548900   -4.314300
H     -33.930500    9.600500    3.637100
H     -34.423400    8.642900    2.237100
H     -33.789700   10.276100    2.011100
N      -1.153600  -16.051600   -5.665900
H      -1.950500  -17.971000   -5.780300
C      -0.210900  -13.820000   -5.541400
C     -15.537300  -17.379800   -3.167200
N      -0.458800  -12.480300   -5.651600
C       1.089100  -14.324800   -5.328600
H     -16.138900  -16.474200   -3.352200
H     -14.902400  -17.228600   -2.266300
C     -16.366500  -18.656600   -3.107800
C       0.582900  -11.619700   -5.550500
C       2.160900  -13.420300   -5.229800
H       1.254100  -15.403200   -5.246300
H     -17.074100  -18.692000   -3.959100
H     -15.712800  -19.542900   -3.232700
C     -17.110100  -18.710400   -1.767500
C       1.904300  -12.040900   -5.341600
H       0.334300  -10.555700   -5.645000
H     -17.618400  -17.742000   -1.583900
H     -16.375000  -18.823400   -0.942400
C     -18.143400  -19.842900   -1.705700
H       2.714000  -11.318300   -5.271300
H     -18.855800  -19.758400   -2.549200
H     -17.647400  -20.823800   -1.829500
C     -18.900100  -19.791200   -0.371300
H     -19.390300  -18.803200   -0.261300
H     -18.173500  -19.859400    0.468300
C     -19.954900  -20.897200   -0.243200
H     -20.689500  -20.817500   -1.067900
H     -19.486000  -21.892800   -0.356700
C     -20.672500  -20.797800    1.109900
H     -19.928500  -20.873000    1.931800
H     -21.132300  -19.795300    1.215000
C     -21.751000  -21.875200    1.280000
H     -21.302900  -22.882300    1.183900
H     -22.494400  -21.799400    0.463000
C     -22.452600  -21.734700    2.638100
H     -21.696900  -21.754700    3.454800
H     -22.936700  -20.741100    2.708000
C     -23.497600  -22.835200    2.858500
H     -23.023000  -23.832100    2.783500
H     -24.255500  -22.804000    2.051700
C     -24.186600  -22.685700    4.222100
H     -23.420000  -22.668100    5.030800
H     -24.699700  -21.705600    4.279800
C     -25.192600  -23.804900    4.477000
H     -25.639100  -23.717500    5.473700
H     -24.726400  -24.794600    4.411200
H     -26.011900  -23.782300    3.748800
C       3.500400  -13.847400   -5.026300
C       4.664000  -14.139000   -4.859900
C       6.034900  -14.455500   -4.670100
C       6.988100  -13.419800   -4.617100
C       6.443800  -15.796700   -4.538600
C       8.346600  -13.725500   -4.435700
H       6.672200  -12.380600   -4.722100
C       7.800600  -16.086000   -4.360600
H       5.707300  -16.602800   -4.585000
C       9.336000  -12.709900   -4.373900
C       8.755900  -15.068000   -4.311500
C       8.268500  -17.512300   -4.276600
C      10.223800  -11.889100   -4.310700
H       9.813300  -15.309000   -4.186700
O       8.904500  -18.055400   -5.172400
N       7.904400  -18.177400   -3.115800
C      11.296300  -10.964500   -4.223900
H       7.625300  -17.663100   -2.269500
C       8.248800  -19.607000   -2.916800
C      12.617900  -11.440400   -4.148900
C      11.066400   -9.577600   -4.200700
C       7.440900  -20.090800   -1.710500
C      13.660200  -10.505900   -4.046100
H      12.827300  -12.507000   -4.172300
C      12.169600   -8.706900   -4.091400
H      10.051800   -9.175800   -4.268800
O       6.689300  -19.466900   -0.994300
O       7.674200  -21.428700   -1.496100
N      13.452500   -9.167500   -4.011700
H      14.707200  -10.828700   -3.986800
C      11.998300   -7.224800   -4.050300
C       7.024900  -22.001400   -0.308200
N      10.714300   -6.772600   -4.174100
C      13.089100   -6.347200   -3.889600
H       5.968600  -22.168700   -0.574400
H       7.092900  -21.254100    0.515600
C       7.795800  -23.281200   -0.016100
C      10.494700   -5.436400   -4.143800
C      12.843900   -4.963800   -3.849500
H      14.105900   -6.742500   -3.800500
H       7.547000  -24.055000   -0.771200
H       8.884300  -23.103300   -0.131500
C       7.473500  -23.776700    1.398800
C      11.522800   -4.496600   -3.982400
H       9.449600   -5.121700   -4.252400
C      13.890000   -4.021500   -3.670500
H       6.385300  -23.690100    1.591900
H       7.962700  -23.117700    2.147500
C       7.911400  -25.232300    1.608800
H      11.305300   -3.431700   -3.960100
C      14.739300   -3.173400   -3.512000
H       7.484800  -25.876500    0.813500
H       9.009900  -25.319300    1.510400
C       7.456500  -25.740600    2.982100
C      15.713300   -2.159100   -3.325900
H       6.351900  -25.689000    3.051800
H       7.836600  -25.055000    3.775400
C       7.925100  -27.174000    3.260700
C      15.328300   -0.807100   -3.404600
C      17.053700   -2.497600   -3.062600
H       7.615000  -27.852000    2.436300
H       9.030500  -27.217200    3.279300
C       7.350200  -27.680000    4.589600
C      16.285300    0.205900   -3.222300
H      14.289600   -0.545300   -3.610000
C      17.995400   -1.478400   -2.886100
H      17.353900   -3.547200   -3.004700
H       7.601900  -26.956200    5.401700
H       6.244100  -27.694200    4.536500
C       7.869100  -29.074400    4.957700
C      15.921400    1.574600   -3.294500
C      17.628200   -0.133200   -2.964500
C      19.445200   -1.823800   -2.685200
H       8.971200  -29.056800    5.056400
H       7.655200  -29.800500    4.138800
C       7.232900  -29.568100    6.263300
C      15.647800    2.752600   -3.345000
H      18.375500    0.652200   -2.836500
O      20.283800   -1.654000   -3.562800
N      19.754400   -2.389900   -1.458800
H       7.468100  -28.848300    7.083700
H       6.129600  -29.566100    6.172100
C       7.719000  -30.973600    6.636600
C      15.363100    4.142500   -3.382900
H      19.127600   -2.290400   -0.650900
C      21.135500   -2.843200   -1.156000
H       8.823500  -30.986800    6.708600
H       7.464000  -31.689500    5.830500
C       7.104600  -31.444300    7.961500
C      16.418900    5.071000   -3.348300
C      14.039700    4.611800   -3.439100
C      21.065600   -3.684000    0.121200
H       7.345800  -30.705500    8.764700
H       6.000200  -31.454800    7.885400
C       7.607600  -32.827900    8.363200
C      16.105400    6.439400   -3.358600
H      17.452600    4.736500   -3.314400
C      13.811300    6.002500   -3.441900
H      13.197500    3.915000   -3.481400
O      20.103600   -3.963300    0.803200
O      22.320900   -4.139000    0.448000
H       7.184300  -33.141800    9.324200
H       8.698800  -32.848400    8.463200
H       7.332600  -33.587400    7.622300
N      14.834400    6.906400   -3.396600
H      16.893700    7.202000   -3.333900
C      12.432200    6.570500   -3.488100
C      22.422200   -4.895700    1.705600
N      11.418400    5.657700   -3.573300
C      12.188800    7.957700   -3.441500
H      21.963300   -5.881400    1.526400
H      21.841500   -4.345400    2.480200
C      23.915300   -4.955100    1.998200
C      10.143400    6.111000   -3.618700
C      10.859700    8.411800   -3.477900
H      13.023800    8.662600   -3.379200
H      24.390200   -5.742100    1.376800
H      24.395800   -4.005900    1.680700
C      24.173100   -5.214600    3.488600
C       9.815000    7.473900   -3.572100
H       9.365600    5.341200   -3.693100
C      10.539700    9.793200   -3.411600
H      23.479700   -5.992000    3.866400
H      23.945500   -4.301200    4.075300
C      25.620700   -5.661400    3.734200
H       8.778200    7.799000   -3.606400
C      10.211400   10.956500   -3.347300
H      25.805800   -6.620400    3.209500
H      26.326300   -4.934400    3.287500
C      25.921200   -5.822200    5.231000
C       9.800000   12.310900   -3.265700
H      25.110400   -6.396900    5.720500
H      25.930700   -4.828700    5.719700
C      27.262800   -6.531100    5.461600
C       8.439700   12.634300   -3.430500
C      10.742300   13.326000   -3.013400
H      27.230600   -7.544000    5.013700
H      28.071400   -5.992600    4.929600
C      27.603700   -6.633300    6.954600
C       8.022200   13.972500   -3.344200
H       7.710600   11.846800   -3.627100
C      10.312200   14.653700   -2.934500
H      11.798700   13.075200   -2.887200
H      27.702600   -5.619300    7.387900
H      26.769000   -7.115700    7.501200
C      28.898600   -7.425700    7.178700
C       6.661400   14.326600   -3.491200
C       8.966700   14.990400   -3.100900
C      11.311200   15.759200   -2.741100
H      29.728000   -6.956200    6.613200
H      28.789400   -8.446400    6.762100
C      29.268900   -7.510200    8.665100
C       5.500000   14.676900   -3.601000
H       8.647400   16.032900   -3.052500
O      11.606100   16.536800   -3.642500
N      11.901200   15.816000   -1.489500
H      29.372000   -6.491300    9.086500
H      28.444800   -7.989100    9.231000
C      30.571300   -8.293900    8.877700
C       4.161400   15.125900   -3.705300
H      11.519500   15.307700   -0.684800
C      12.942600   16.831000   -1.190800
H      31.397200   -7.814100    8.316800
H      30.474500   -9.312500    8.454600
C      30.940800   -8.384300   10.364300
C       3.894900   16.504000   -3.784100
C       3.088600   14.218000   -3.711500
C      13.611400   16.427700    0.125900
H      31.009800   -7.367100   10.798500
H      30.130700   -8.897000   10.922400
C      32.259600   -9.122800   10.580000
C       2.557100   16.922700   -3.853000
H       4.706400   17.227900   -3.790500
C       1.774700   14.721800   -3.777100
H       3.264500   13.139100   -3.666400
O      13.396000   15.471900    0.835600
O      14.587600   17.345300    0.436700
H      32.494900   -9.204500   11.647500
H      33.096100   -8.603800   10.098400
H      32.226100  -10.139400   10.172700
N       1.511800   16.060500   -3.842600
H       2.297800   17.987000   -3.915300
C       0.587200   13.818600   -3.767900
C      15.260300   17.166400    1.730500
N       0.859300   12.479100   -3.735700
C      -0.731300   14.315000   -3.782500
H      15.947500   16.312000    1.621300
H      14.483200   16.929500    2.492400
C      15.962100   18.495700    1.975200
C      -0.179000   11.610200   -3.720600
C      -1.797800   13.400900   -3.757700
H      -0.913600   15.393800   -3.812500
H      16.890900   18.541700    1.370700
H      15.328700   19.326000    1.598000
C      16.277000   18.695100    3.463400
C      -1.520000   12.021400   -3.729000
H       0.088800   10.546800   -3.697300
C      -3.149500   13.832800   -3.749100
H      16.631600   17.745200    3.910000
H      15.351800   18.956100    4.015900
C      17.341900   19.782600    3.663500
H      -2.326400   11.292600   -3.711700
C      -4.317300   14.150400   -3.728900
H      18.262800   19.504500    3.112300
H      17.000400   20.737000    3.218200
C      17.670400   19.988700    5.148400
C      -5.693900   14.489500   -3.695900
H      17.869200   19.010400    5.629000
H      16.792600   20.414900    5.670800
C      18.886000   20.906700    5.337200
C      -6.658500   13.466600   -3.770000
C      -6.096000   15.833300   -3.581200
H      19.770200   20.461500    4.839000
H      18.710400   21.876300    4.831900
C      19.188600   21.141300    6.823500
C      -8.024900   13.789400   -3.727900
H      -6.345700   12.425400   -3.861500
C      -7.460500   16.137700   -3.542700
H      -5.347900   16.629200   -3.529300
H      18.336200   21.661000    7.301900
H      19.285000   20.169300    7.346400
C      20.471600   21.960500    7.018100
C      -9.015300   12.777100   -3.792000
C      -8.428800   15.133800   -3.616700
C      -7.908000   17.571300   -3.483400
H      20.383600   22.927900    6.485300
H      21.326100   21.431600    6.551100
C      20.765700   22.208300    8.503600
C      -9.888800   11.940400   -3.837500
H      -9.490500   15.386600   -3.595400
O      -8.368200   18.157900   -4.456200
N      -7.744100   18.185800   -2.253400
H      19.898900   22.707200    8.978700
H      20.883600   21.238800    9.026900
C      22.025800   23.060400    8.704500
C     -10.937200   10.985800   -3.876100
H      -7.562500   17.651000   -1.396200
C      -8.050600   19.625500   -2.074100
H      21.926600   24.019700    8.159700
H      22.903400   22.550300    8.260900
C      22.291700   23.335600   10.190600
C     -12.269200   11.417600   -4.005700
C     -10.667900    9.610800   -3.771200
C      -7.344800   20.076400   -0.793400
H      21.422400   23.855000   10.639800
H      22.386600   22.375700   10.737800
C      23.551600   24.173500   10.395900
C     -13.285800   10.449900   -4.017500
H     -12.505400   12.475200   -4.094100
C     -11.746900    8.705400   -3.787700
H      -9.641200    9.244600   -3.677700
O      -6.663100   19.429600   -0.029600
O      -7.578100   21.414800   -0.579000
H      23.735700   24.354400   11.461100
H      23.470700   25.150900    9.906700
H      24.439400   23.676400    9.989100
N     -13.043000    9.121900   -3.906900
H     -14.340400   10.736400   -4.116200
C     -11.537700    7.233200   -3.668000
C      -7.042300   21.954800    0.678300
N     -10.237700    6.823500   -3.564900
C     -12.613100    6.323500   -3.656500
H      -5.948300   22.021300    0.564200
H      -7.292000   21.232400    1.489900
C      -7.728700   23.302400    0.850100
C      -9.986200    5.497300   -3.452900
C     -12.336000    4.951400   -3.532700
H     -13.642500    6.684900   -3.743600
H      -7.282800   24.048200    0.159600
H      -8.792900   23.225400    0.545700
C      -7.613600   23.772200    2.305600
C     -10.999000    4.526400   -3.431300
H      -8.928900    5.216600   -3.377000
C     -13.375500    3.985900   -3.500700
H      -6.564300   23.680400    2.650400
H      -8.206900   23.106900    2.968100
C      -8.080800   25.223800    2.468000
H     -10.756600    3.470700   -3.338400
C     -14.231600    3.131100   -3.462500
H      -7.533900   25.879300    1.760300
H      -9.149100   25.312400    2.191600
C      -7.863600   25.718000    3.904400
C     -15.217900    2.113500   -3.413300
H      -6.793600   25.630600    4.176100
H      -8.407100   25.056100    4.618100
C      -8.322700   27.170900    4.070700
C     -14.819900    0.766200   -3.332100
C     -16.585300    2.446900   -3.440600
H      -7.765400   27.819100    3.363800
H      -9.388500   27.266900    3.786300
C      -8.117100   27.676800    5.504900
C     -15.790900   -0.247800   -3.279300
H     -13.759800    0.508900   -3.312900
C     -17.539000    1.425500   -3.387700
H     -16.895900    3.493000   -3.508000
H      -8.689800   27.042500    6.218400
H      -7.055500   27.565300    5.798200
C      -8.539700   29.145900    5.633100
C     -15.418500   -1.612400   -3.192400
C     -17.159400    0.083700   -3.310600
C     -19.002700    1.758100   -3.456500
H      -9.578900   29.273100    5.271600
H      -7.911500   29.770800    4.965300
C      -8.427400   29.659100    7.074200
C     -15.142300   -2.788000   -3.114600
H     -17.914300   -0.703800   -3.280400
O     -19.678500    1.591900   -4.466400
N     -19.529500    2.272300   -2.283900
H      -9.096000   29.071900    7.737100
H      -7.402800   29.490500    7.458000
C      -8.774300   31.152000    7.160800
C     -14.852100   -4.172900   -3.018700
H     -19.026700    2.213700   -1.388300
C     -20.938800    2.725100   -2.208100
H      -9.768800   31.339000    6.711500
H      -8.058500   31.739800    6.553400
C      -8.759300   31.654900    8.610800
C     -15.896100   -5.111700   -3.098300
C     -13.533900   -4.624500   -2.837400
C     -21.040100    3.642100   -0.986100
H      -9.512100   31.102000    9.207500
H      -7.778900   31.433500    9.076700
C      -9.039800   33.153800    8.694700
C     -15.577000   -6.474300   -2.988300
H     -16.924200   -4.790100   -3.243800
C     -13.300000   -6.009800   -2.734600
H     -12.700900   -3.918000   -2.778500
O     -20.168700    4.003100   -0.229500
O     -22.341500    4.059500   -0.822000
H      -9.042500   33.497700    9.735200
H     -10.014800   33.407500    8.263500
H      -8.282600   33.737300    8.158700
N     -14.312600   -6.924700   -2.807200
H     -16.355400   -7.245500   -3.045800
C     -11.927900   -6.560600   -2.538800
C     -22.594400    4.860900    0.382500
N     -10.918400   -5.640600   -2.482200
C     -11.688300   -7.943800   -2.419400
H     -22.126900    5.846500    0.224800
H     -22.103100    4.346000    1.240500
C     -24.110400    4.910400    0.508200
C      -9.650700   -6.084000   -2.308800
C     -10.367500   -8.387800   -2.236900
H     -12.519700   -8.653700   -2.470800
H     -24.533800    5.572100   -0.274300
H     -24.540500    3.908100    0.307000
C     -24.502200    5.399100    1.907700
C      -9.326600   -7.443400   -2.181300
H      -8.874500   -5.309900   -2.272600
C     -10.064000   -9.768000   -2.107300
H     -23.918000    6.304300    2.168400
H     -24.226800    4.636200    2.667000
C     -26.000400    5.714900    2.000700
H      -8.295500   -7.759200   -2.044700
C      -9.766200  -10.935800   -1.993300
H     -26.294500    6.407300    1.186900
H     -26.594800    4.795200    1.841400
C     -26.339500    6.338800    3.360000
C      -9.395900  -12.298100   -1.860600
H     -25.759700    7.272000    3.500500
H     -26.008900    5.655400    4.178400
C     -27.837100    6.634300    3.497600
C      -8.039200  -12.636000   -1.701300
C     -10.377400  -13.307200   -1.890000
H     -28.165100    7.304000    2.677800
H     -28.422200    5.702700    3.375600
C     -28.152100    7.278300    4.853700
C      -7.663800  -13.984400   -1.573900
H      -7.279200  -11.853500   -1.680700
C      -9.988400  -14.644100   -1.763000
H     -11.431300  -13.045300   -2.017600
H     -27.809200    6.606600    5.677400
H     -27.572000    8.213600    4.972400
C     -29.649300    7.572100    5.005000
C      -6.302600  -14.347300   -1.416600
C      -8.645200  -14.994700   -1.607300
C     -11.019900  -15.736700   -1.843700
H     -30.233000    6.639600    4.880600
H     -29.982600    8.246100    4.191200
C     -29.962200    8.206400    6.365800
C      -5.148900  -14.689400   -1.284400
H      -8.354000  -16.042700   -1.518900
O     -11.170400  -16.437000   -2.837500
N     -11.795600  -15.877100   -0.704200
H     -29.606800    7.534000    7.184100
H     -29.391800    9.147200    6.485500
C     -31.462300    8.480900    6.527300
C      -3.808300  -15.129300   -1.132000
H     -11.513400  -15.461300    0.194600
C     -12.896200  -16.868400   -0.635300
H     -32.035100    7.542000    6.401200
H     -31.812500    9.154500    5.720600
C     -31.776800    9.101100    7.895100
C      -3.532900  -16.506700   -1.059400
C      -2.746100  -14.212700   -1.052800
C     -13.796800  -16.451900    0.531900
H     -31.411700    8.425400    8.707300
H     -31.215600   10.047200    8.020400
C     -33.270500    9.360000    8.071000
C      -2.198300  -16.913500   -0.907400
H      -4.334600  -17.238200   -1.122500
C      -1.434600  -14.704300   -0.900700
H      -2.928200  -13.135500   -1.110700
O     -13.709400  -15.488600    1.258600
O     -14.815500  -17.365900    0.687900
H     -33.490000    9.759300    9.067700
H     -33.858200    8.442900    7.949000
H     -33.642200   10.086000    7.338600
N      -1.164300  -16.042000   -0.826700
H      -1.932800  -17.976400   -0.847900
C      -0.258200  -13.790900   -0.812100
C     -15.696700  -17.137700    1.841300
N      -0.534100  -12.455900   -0.911600
C       1.054600  -14.273400   -0.636800
H     -16.375700  -16.314200    1.566700
H     -15.060000  -16.829900    2.703200
C     -16.403200  -18.465700    2.078300
C       0.493900  -11.576800   -0.840900
C       2.109700  -13.348700   -0.561200
H       1.240100  -15.349300   -0.563900
H     -17.115600  -18.681500    1.250600
H     -15.669900  -19.296500    2.050500
C     -17.131100  -18.427900    3.427500
C       1.827900  -11.973800   -0.666700
H       0.222900  -10.517400   -0.928300
H     -17.696900  -17.479400    3.524300
H     -16.386900  -18.419100    4.253800
C     -18.089200  -19.613200    3.603000
H       2.625500  -11.236900   -0.615400
H     -18.788200  -19.680800    2.741700
H     -17.522700  -20.563600    3.601500
C     -18.886600  -19.470500    4.905300
H     -19.455900  -18.520400    4.894800
H     -18.178600  -19.385900    5.765000
C     -19.845300  -20.644400    5.136400
H     -20.548100  -20.749000    4.279700
H     -19.281200  -21.595600    5.172100
C     -20.636100  -20.449800    6.436200
H     -19.924400  -20.349400    7.291600
H     -21.193800  -19.494100    6.398600
C     -21.605900  -21.606600    6.701500
H     -21.051200  -22.562900    6.754400
H     -22.314700  -21.723300    5.849800
C     -22.388000  -21.381700    8.001700
H     -21.672800  -21.321900    8.857600
H     -22.901200  -20.401600    7.972500
C     -23.411400  -22.496800    8.247200
H     -22.908700  -23.482800    8.235400
H     -24.145300  -22.526500    7.417900
C     -24.143000  -22.301700    9.581700
H     -23.395600  -22.241200   10.410600
H     -24.673600  -21.330100    9.584900
C     -25.130300  -23.431600    9.859700
H     -25.635800  -23.289400   10.821600
H     -24.630900  -24.406600    9.892400
H     -25.906500  -23.488000    9.087800
C       3.454600  -13.762800   -0.374600
C       4.616600  -14.060000   -0.209900
C       5.986000  -14.369300   -0.008600
C       6.930300  -13.324400    0.016200
C       6.400700  -15.702400    0.172900
C       8.288700  -13.613100    0.225900
H       6.607300  -12.292000   -0.130000
C       7.756100  -15.973600    0.381700
H       5.669700  -16.514800    0.140100
C       9.264400  -12.585300    0.269400
C       8.704000  -14.947000    0.406000
C       8.243500  -17.388700    0.522200
C      10.134900  -11.746000    0.326200
H       9.761500  -15.174700    0.554400
O       8.873600  -17.957300   -0.359000
N       7.947100  -17.992100    1.737000
C      11.187400  -10.798900    0.419200
H       7.497500  -17.472600    2.498500
C       8.310800  -19.406900    2.013100
C      12.517300  -11.248300    0.510000
C      10.927000   -9.418100    0.443100
C       7.808900  -19.734500    3.423400
C      13.537900  -10.293200    0.634000
H      12.749300  -12.310500    0.485700
C      12.009300   -8.525800    0.575700
H       9.904800   -9.037400    0.361900
O       7.374000  -18.955400    4.241700
O       7.905100  -21.077300    3.668800
N      13.301000   -8.959700    0.674300
H      14.590700  -10.594100    0.707900
C      11.806400   -7.048500    0.628200
C       7.458000  -21.516500    5.005900
N      10.507800   -6.625600    0.568700
C      12.883500   -6.147600    0.741900
H       6.356700  -21.549900    4.962400
H       7.781200  -20.762200    5.747300
C       8.101900  -22.879200    5.222500
C      10.259400   -5.295100    0.614900
C      12.608900   -4.770600    0.801100
H      13.911900   -6.519600    0.783700
H       7.810800  -23.586600    4.409200
H       9.204900  -22.797900    5.153800
C       7.680500  -23.433200    6.590000
C      11.273200   -4.332700    0.731500
H       9.203100   -5.003700    0.559100
C      13.641000   -3.807600    0.946600
H       6.574600  -23.448100    6.665000
H       8.029100  -22.751200    7.392000
C       8.229200  -24.842800    6.846700
H      11.032500   -3.272700    0.770200
C      14.477900   -2.944500    1.088600
H       7.887900  -25.547700    6.051600
H       9.334100  -24.839000    6.787900
C       7.775900  -25.358200    8.219900
C      15.422200   -1.903300    1.275600
H       6.670100  -25.339400    8.281400
H       8.132200  -24.671400    9.012900
C       8.284500  -26.777300    8.501600
C      14.988500   -0.564900    1.209100
C      16.771400   -2.197900    1.548900
H       7.923700  -27.482100    7.714600
H       9.389000  -26.804300    8.442000
C       7.820100  -27.268500    9.879600
C      15.904500    0.478600    1.420500
H      13.942500   -0.338200    0.995400
C      17.668300   -1.146400    1.760500
H      17.112000   -3.236200    1.590300
H       8.208000  -26.597000   10.669900
H       6.716500  -27.206400    9.947400
C       8.277000  -28.707000   10.149500
C      15.504100    1.837300    1.386500
C      17.254500    0.185500    1.693600
C      19.121400   -1.416800    2.028600
H       9.379700  -28.773300   10.087000
H       7.890100  -29.386600    9.351900
C       7.800400  -29.206000   11.519800
C      15.221000    3.013500    1.390100
H      17.969600    0.996300    1.847100
O      19.997100   -1.216800    1.198300
N      19.390800   -1.885100    3.306300
H       8.290000  -28.622800   12.322900
H       6.714600  -29.022300   11.633800
C       8.094800  -30.701400   11.699500
C      14.921000    4.399200    1.425200
H      18.653500   -1.953200    4.017000
C      20.764200   -2.260800    3.728900
H       9.176500  -30.893200   11.565000
H       7.587800  -31.283500   10.904200
C       7.644400  -31.206700   13.076800
C      15.964700    5.338400    1.503900
C      13.590300    4.849500    1.406200
C      20.665500   -2.730700    5.183500
H       8.199900  -30.673100   13.872500
H       6.576100  -30.963200   13.238300
C       7.856200  -32.712500   13.219700
C      15.632100    6.700400    1.571500
H      17.003600    5.017400    1.513400
C      13.343400    6.233700    1.483600
H      12.758600    4.142200    1.336300
O      19.721500   -2.606100    5.930600
O      21.824200   -3.346600    5.565300
H       7.557300  -33.062800   14.213800
H       8.907700  -32.986800   13.077600
H       7.269200  -33.274300   12.484200
N      14.353800    7.149500    1.568600
H      16.410000    7.471800    1.634000
C      11.955800    6.779900    1.489100
C      21.864400   -3.809200    6.967100
N      10.951300    5.852300    1.485300
C      11.698400    8.164100    1.505500
H      21.114100   -4.611700    7.065200
H      21.586700   -2.957100    7.611900
C      23.297000   -4.282500    7.165500
C       9.669500    6.289300    1.492500
C      10.362900    8.601000    1.522400
H      12.525900    8.880300    1.504800
H      23.502600   -5.154700    6.511500
H      24.005400   -3.495100    6.836600
C      23.532400   -4.642200    8.638300
C       9.326900    7.649800    1.511600
H       8.897900    5.509400    1.485100
C      10.037300    9.981200    1.561200
H      22.782600   -5.387900    8.969900
H      23.373600   -3.749500    9.275300
C      24.944600   -5.195000    8.865200
H       8.285100    7.961600    1.518100
C       9.714800   11.146800    1.607900
H      25.103800   -6.094500    8.236500
H      25.699200   -4.456500    8.530600
C      25.178800   -5.545500   10.341700
C       9.299800   12.499800    1.687200
H      24.417600   -6.273400   10.683000
H      25.038900   -4.645400   10.971000
C      26.583700   -6.121000   10.559500
C       7.927400   12.803200    1.609100
C      10.244300   13.527700    1.870100
H      26.722400   -7.023100    9.929300
H      27.345800   -5.395400   10.214300
C      26.836600   -6.476800   12.031500
C       7.499300   14.136800    1.715300
H       7.197100   12.004400    1.469200
C       9.799300   14.848100    1.981600
H      11.311200   13.293900    1.921600
H      26.706300   -5.580000   12.666900
H      26.080500   -7.205800   12.380800
C      28.246200   -7.052900   12.220200
C       6.124400   14.474900    1.663700
C       8.442300   15.166700    1.898000
C      10.778500   15.969800    2.183400
H      28.998900   -6.320200   11.868100
H      28.372800   -7.948300   11.578300
C      28.531300   -7.424600   13.681100
C       4.963000   14.813800    1.642300
H       8.110700   16.204100    1.971600
O      11.107300   16.747800    1.300900
N      11.257400   16.062200    3.485000
H      28.405800   -6.536000   14.329300
H      27.787200   -8.163700   14.034900
C      29.949300   -7.991000   13.839100
C       3.613200   15.248200    1.638500
H      10.897900   15.455100    4.230200
C      12.249100   17.092100    3.882700
H      30.692700   -7.249000   13.488500
H      30.078600   -8.875100   13.184200
C      30.251100   -8.379400   15.292800
C       3.325300   16.624500    1.656800
C       2.555000   14.323800    1.632900
C      12.585200   16.834800    5.355200
H      30.116800   -7.501500   15.954300
H      29.519200   -9.134500   15.640300
C      31.668700   -8.928100   15.444600
C       1.980300   17.023900    1.678000
H       4.125300   17.360900    1.654400
C       1.233200   14.808900    1.657800
H       2.749000   13.247500    1.611400
O      11.989100   16.118700    6.127400
O      13.695800   17.541500    5.721000
H      31.875000   -9.211100   16.482900
H      32.421700   -8.188100   15.150800
H      31.825600   -9.818300   14.825100
N       0.948900   16.145200    1.683400
H       1.704300   18.086000    1.693000
C       0.060700   13.886800    1.663600
C      14.098400   17.408900    7.135600
N       0.351200   12.552900    1.731800
C      -1.262700   14.364100    1.605500
H      14.430100   16.367100    7.281300
H      13.210900   17.610100    7.761000
C      15.208300   18.436200    7.304500
C      -0.675300   11.669200    1.738500
C      -2.316600   13.434700    1.620200
H      -1.460200   15.439100    1.551000
H      16.074200   18.167100    6.666000
H      14.866500   19.424600    6.934700
C      15.627800   18.526900    8.777000
C      -2.021700   12.061200    1.685500
H      -0.394100   10.609800    1.790200
C      -3.671100   13.855400    1.578900
H      15.918400   17.525300    9.151400
H      14.765500   18.843700    9.396800
C      16.791500   19.507700    8.969100
H      -2.817700   11.320300    1.695600
C      -4.838500   14.173800    1.553800
H      17.659900   19.188400    8.358500
H      16.509000   20.508800    8.589000
C      17.201200   19.605900   10.445300
C      -6.216900   14.503800    1.537700
H      17.472600   18.603800   10.830100
H      16.339700   19.939700   11.055600
C      18.378300   20.571700   10.634000
C      -7.168600   13.466800    1.527300
C      -6.634400   15.848500    1.547500
H      19.239100   20.240100   10.019300
H      18.104700   21.575200   10.253600
C      18.803200   20.671500   12.105500
C      -8.539200   13.774700    1.524800
H      -6.842200   12.425000    1.521700
C      -8.002400   16.138300    1.554300
H      -5.895100   16.653800    1.544000
H      17.943900   20.988600   12.727000
H      19.095300   19.672900   12.483000
C      19.966300   21.657300   12.280500
C      -9.515600   12.747500    1.522100
C      -8.958200   15.119300    1.535500
C      -8.481100   17.564300    1.563600
H      19.665200   22.659400   11.917400
H      20.819700   21.349100   11.642900
C      20.421400   21.751300   13.742700
C     -10.375300   11.895300    1.527900
H     -10.022900   15.359600    1.525100
O      -8.994500   18.111800    0.599800
N      -8.310900   18.196400    2.790500
H      19.570700   22.050300   14.384600
H      20.736100   20.753900   14.105200
C      21.573600   22.752500   13.905200
C     -11.415000   10.930600    1.540600
H      -7.951100   17.684100    3.605000
C      -8.704400   19.610100    3.019600
H      21.257400   23.753500   13.553200
H      22.422600   22.461300   13.256700
C      22.043200   22.840500   15.364100
C     -12.754800   11.355300    1.488800
C     -11.131600    9.555700    1.611000
C      -8.350400   19.937100    4.474800
H      21.195200   23.127100   16.016300
H      22.369500   21.842200   15.715400
C      23.182300   23.844100   15.530900
C     -13.764500   10.381300    1.516400
H     -13.001700   12.412500    1.427500
C     -12.204300    8.643800    1.635600
H     -10.099700    9.195400    1.646300
O      -7.977000   19.157400    5.323200
O      -8.503300   21.272400    4.727900
H      23.512900   23.898000   16.574200
H      22.877600   24.853200   15.231600
H      24.053600   23.571000   14.924800
N     -13.507700    9.054000    1.592800
H     -14.824300   10.662800    1.478000
C     -11.983700    7.169800    1.714100
C      -8.209100   21.688800    6.114700
N     -10.683900    6.764600    1.827200
C     -13.054200    6.255700    1.676700
H      -7.110300   21.702900    6.205300
H      -8.631000   20.930300    6.800400
C      -8.853300   23.058700    6.272600
C     -10.427100    5.436200    1.900500
C     -12.772100    4.880900    1.761200
H     -14.084900    6.613900    1.583800
H      -8.440300   23.776600    5.521900
H      -9.936900   23.001500    6.048900
C      -8.619400   23.569300    7.700500
C     -11.435100    4.460100    1.872500
H      -9.369300    5.157100    1.985800
C     -13.810500    3.914100    1.742900
H      -7.538000   23.532000    7.942800
H      -9.114100   22.890100    8.424300
C      -9.138800   24.997900    7.904300
H     -11.188000    3.402800    1.936300
C     -14.670600    3.062000    1.736300
H      -8.658000   25.694000    7.179400
H     -10.222500   25.045900    7.684900
C      -8.874700   25.470600    9.341200
C     -15.651600    2.038400    1.738400
H      -7.805900   25.330100    9.595800
H      -9.438500   24.835900   10.052900
C      -9.262500   26.941200    9.539400
C     -15.240800    0.693400    1.804800
C     -17.021800    2.358100    1.682100
H      -8.687100   27.583400    8.840200
H     -10.326900   27.090700    9.274500
C      -9.017900   27.395000   10.985600
C     -16.201200   -0.331800    1.814300
H     -14.178100    0.447200    1.847300
C     -17.965400    1.327500    1.698000
H     -17.339500    3.402300    1.618800
H      -9.650100   26.804500   11.676600
H      -7.972300   27.182200   11.279300
C      -9.311900   28.891600   11.156200
C     -15.812800   -1.693400    1.882200
C     -17.572100   -0.012800    1.759400
C     -19.435500    1.634400    1.613000
H     -10.345400   29.111300   10.825700
H      -8.648800   29.479500   10.491500
C      -9.125400   29.348000   12.609600
C     -15.518000   -2.865600    1.942200
H     -18.317600   -0.809500    1.758900
O     -20.100000    1.474400    0.599800
N     -19.984700    2.092900    2.806200
H      -9.784600   28.759900   13.276600
H      -8.091700   29.133900   12.942900
C      -9.426600   30.844600   12.767200
C     -15.223000   -4.251500    2.018400
H     -19.426100    2.138200    3.666500
C     -21.424000    2.438900    2.928700
H     -10.458500   31.059900   12.428900
H      -8.763800   31.435700   12.106000
C      -9.255100   31.306800   14.220900
C     -16.275300   -5.183900    1.976000
C     -13.901200   -4.712000    2.143900
C     -21.634500    2.986100    4.344700
H      -9.914500   30.713700   14.884700
H      -8.220700   31.104400   14.561100
C      -9.567500   32.793100   14.380200
C     -15.961600   -6.548600    2.069400
H     -17.306500   -4.854800    1.873200
C     -13.673100   -6.099300    2.234100
H     -13.061600   -4.011400    2.173100
O     -20.843500    2.945700    5.262100
O     -22.871000    3.557800    4.469900
H      -9.447000   33.113200   15.421200
H     -10.596900   33.023700   14.083000
H      -8.903500   33.413200   13.767400
N     -14.693800   -7.007100    2.201100
H     -16.746300   -7.315100    2.039800
C     -12.300200   -6.665800    2.378300
C     -23.178000    4.130200    5.797400
N     -11.284000   -5.756000    2.468000
C     -12.069200   -8.054700    2.426400
H     -22.693000    5.120700    5.814500
H     -22.728800    3.480300    6.571800
C     -24.696900    4.195600    5.881900
C     -10.017400   -6.216200    2.600400
C     -10.750500   -8.516700    2.574300
H     -12.905500   -8.756200    2.350600
H     -25.110500    4.797900    5.035100
H     -25.134600    3.185900    5.760000
C     -25.107700    4.809900    7.227300
C      -9.701000   -7.582400    2.657700
H      -9.234800   -5.449600    2.665000
C     -10.455800   -9.902700    2.653900
H     -24.607500    5.790800    7.358400
H     -24.740900    4.170200    8.055600
C     -26.625700    4.991600    7.359900
H      -8.670500   -7.911100    2.766500
C     -10.161400  -11.073700    2.737900
H     -27.016800    5.629200    6.530600
H     -27.139400    4.017700    7.254600
C     -26.973900    5.632400    8.710900
C      -9.765100  -12.430600    2.850300
H     -26.426400    6.589500    8.821100
H     -26.614800    4.983800    9.534500
C     -28.478700    5.881900    8.876400
C      -8.392400  -12.734600    2.929800
C     -10.721900  -13.463000    2.893000
H     -28.853200    6.546400    8.060700
H     -29.037600    4.933700    8.767400
C     -28.777400    6.517300   10.241500
C      -7.977600  -14.070100    3.055200
H      -7.651400  -11.933700    2.894300
C     -10.292000  -14.786900    3.021200
H     -11.787000  -13.228800    2.818500
H     -28.431400    5.843800   11.050200
H     -28.190700    7.449700   10.356600
C     -30.269400    6.820400   10.427100
C      -6.604000  -14.405600    3.146800
C      -8.932600  -15.103500    3.099600
C     -11.275900  -15.922300    3.026300
H     -30.865800    5.898900   10.288000
H     -30.619500    7.524300    9.633900
C     -30.544900    7.419000   11.813100
C      -5.443900  -14.737700    3.236200
H      -8.609300  -16.142300    3.188000
O     -11.428800  -16.670200    2.069900
N     -11.976900  -16.078500    4.214600
H     -30.289000    6.679100   12.596400
H     -29.879000    8.285900   11.990300
C     -32.007900    7.855700   11.965500
C      -4.097400  -15.163400    3.360300
H     -11.770200  -15.501400    5.037800
C     -12.995800  -17.147600    4.383500
H     -32.684100    7.012900   11.726700
H     -32.244600    8.647200   11.228300
C     -32.293600    8.363300   13.386400
C      -3.805700  -16.538000    3.423600
C      -3.047900  -14.232200    3.435500
C     -13.582400  -16.989400    5.790800
H     -32.089400    7.558800   14.120200
H     -31.598200    9.187200   13.640500
C     -33.735300    8.842300   13.538800
C      -2.466400  -16.928100    3.572900
H      -4.598700  -17.278700    3.359100
C      -1.731300  -14.708100    3.588500
H      -3.242000  -13.157400    3.380500
O     -13.154700  -16.290600    6.681100
O     -14.703600  -17.759600    5.937200
H     -33.934400    9.176700   14.563300
H     -34.452000    8.045600   13.309400
H     -33.954000    9.682600   12.870600
N      -1.444800  -16.042400    3.660300
H      -2.186500  -17.987500    3.629000
C      -0.567800  -13.781600    3.687800
C     -15.362800  -17.684300    7.256800
N      -0.860000  -12.448200    3.765200
C       0.758100  -14.257300    3.705000
H     -15.985200  -16.774300    7.227800
H     -14.583400  -17.579400    8.035000
C     -16.170300  -18.968700    7.388300
C       0.167100  -11.570600    3.857800
C       1.804100  -13.335700    3.804000
H       0.956800  -15.330200    3.643800
H     -16.908300  -19.054300    6.552400
H     -15.511100  -19.852600    7.285000
C     -16.891000  -18.980200    8.742900
C       1.514900  -11.971900    3.881000
H      -0.112000  -10.512000    3.915900
H       2.837400  -13.683300    3.820000
H     -17.457400  -18.035900    8.872000
H     -16.144300  -18.997900    9.562800
C     -17.843600  -20.172900    8.897900
H       2.309800  -11.234800    3.957500
H     -18.606700  -20.173100    8.082800
H     -17.288400  -21.123400    8.786700
C     -18.545500  -20.127200   10.262800
H     -19.055900  -19.152100   10.389100
H     -17.791000  -20.177500   11.072600
C     -19.560400  -21.264200   10.435400
H     -20.332700  -21.219400    9.630300
H     -19.058900  -22.242800   10.314600
C     -20.244700  -21.186800   11.807500
H     -19.487600  -21.274100   12.610900
H     -20.707900  -20.189400   11.939400
C     -21.309100  -22.277300   11.976500
H     -20.851400  -23.277200   11.856000
H     -22.072400  -22.196500   11.164700
C     -22.002700  -22.179600   13.341800
H     -21.267300  -22.355500   14.150200
H     -22.382800  -21.151700   13.500200
C     -23.157700  -23.183300   13.455800
H     -22.784800  -24.210600   13.281100
H     -23.902200  -22.995900   12.657100
C     -23.840300  -23.103700   14.828300
H     -23.107700  -23.333700   15.626400
H     -24.180700  -22.067300   15.020200
C     -25.026200  -24.061200   14.924600
H     -25.493900  -24.014700   15.914400
H     -24.721100  -25.099900   14.754600
H     -25.799100  -23.821900   14.185500
C     -12.402800  -18.544900    4.229800
H     -11.579200  -18.733000    4.929000
H     -13.164900  -19.319600    4.386800
H     -11.996500  -18.677300    3.211600
C     -12.376000  -18.286200   -0.414800
H     -11.747000  -18.346800    0.487900
H     -13.201000  -19.000400   -0.298600
H     -11.762900  -18.609200   -1.268100
C     -12.239700  -18.329100   -5.542200
H     -11.676200  -18.593400   -6.447800
H     -11.570900  -18.465600   -4.680900
H     -13.068300  -19.043400   -5.442000
C     -22.332000    1.234000    2.703200
H     -22.112600    0.406100    3.388200
H     -23.388700    1.506100    2.827600
H     -22.204600    0.847100    1.677400
C     -21.907000    1.553200   -2.072000
H     -21.663500    0.928600   -1.198400
H     -22.941000    1.902200   -1.957500
H     -21.861100    0.911800   -2.964200
C     -21.721000    1.753300   -7.294700
H     -21.615300    1.211500   -8.244700
H     -21.544000    1.037000   -6.480300
H     -22.761100    2.098800   -7.217900
C     -10.192300   19.847700    2.783100
H     -10.826200   19.205400    3.406000
H     -10.464500   20.891700    2.987100
H     -10.449900   19.631300    1.731300
C      -9.550700   19.882200   -1.967100
H     -10.001100   19.307100   -1.141900
H      -9.762100   20.944400   -1.792800
H     -10.058900   19.582200   -2.895400
C      -8.924600   20.023900   -7.049600
H      -9.325500   19.661300   -8.005800
H      -9.436400   19.475900   -6.242800
H      -9.187500   21.085500   -6.954400
C      11.715800   18.512000    3.717200
H      10.793800   18.685900    4.284500
H      12.456700   19.255600    4.038700
H      11.483000   18.707900    2.655400
C      12.355400   18.235400   -1.078800
H      11.561300   18.281000   -0.316200
H      13.123900   18.968800   -0.806000
H      11.913100   18.543200   -2.038200
C      13.236700   18.094200   -5.764600
H      12.750800   18.315800   -6.727700
H      12.451800   18.113700   -4.990400
H      13.946700   18.901600   -5.550400
C      21.746600   -1.098200    3.629400
H      21.435000   -0.229500    4.221700
H      22.749400   -1.396000    3.962000
H      21.828600   -0.757400    2.581600
C      22.100400   -1.676300   -0.965200
H      21.750800   -0.987100   -0.179100
H      23.101700   -2.026600   -0.687100
H      22.187700   -1.094700   -1.895300
C      22.605500   -1.992800   -5.684500
H      22.608200   -1.384700   -6.601800
H      22.208100   -1.363500   -4.871900
H      23.645600   -2.243800   -5.443500
C       9.815000  -19.647800    1.935200
H      10.381500  -19.003100    2.617800
H      10.062800  -20.691200    2.170300
H      10.182700  -19.437200    0.915100
C       9.739200  -19.814700   -2.661700
H      10.086600  -19.225800   -1.797300
H       9.970100  -20.869200   -2.468600
H      10.324700  -19.492000   -3.536000
C      10.108700  -20.251000   -7.518500
H      10.700000  -19.938600   -8.391800
H      10.468200  -19.679600   -6.650900
H      10.316300  -21.313100   -7.333500
H       8.304200  -20.533700   -8.722600
H     -13.355300  -16.764700   -6.585200
H     -20.880800    3.581800   -8.150200
H      -6.915300   20.327400   -7.866400
H      14.670000   16.713900   -6.675400
H      22.126800   -3.831400   -6.773300
H       7.773500  -20.072800    1.259200
H       7.922900  -20.191300   -3.836800
H     -13.817900  -16.989100    3.610100
H     -13.501000  -16.814800   -1.599900
H     -21.669000    3.252300    2.168500
H     -21.183500    3.330000   -3.142500
H      -8.093400   20.275700    2.325000
H      -7.614100   20.205700   -2.953700
H      13.187000   16.960200    3.248000
H      13.725600   16.797300   -2.012800
H      21.123200   -3.124700    3.076800
H      21.490600   -3.510200   -2.006100

