80

 C                 -1.83746547   -1.26031089   -2.64183210
 C                 -2.23377464   -0.44530464   -1.59629311
 C                 -2.97202562    0.74376175   -1.82087787
 C                 -3.31588515    1.12132854   -3.09875397
 C                 -2.92846505    0.32292678   -4.21114884
 C                 -2.17759086   -0.88591042   -3.98914594
 C                 -1.80497081   -1.65168086   -5.13438395
 C                 -2.15137920   -1.26032770   -6.41259946
 C                 -2.89408955   -0.07299655   -6.62268583
 C                 -3.26872131    0.69726040   -5.54204998
 H                 -3.83932470    1.61916007   -5.69139237
 H                 -3.16483903    0.23027042   -7.63807388
 H                 -1.84718991   -1.86995187   -7.26844963
 H                 -1.22675201   -2.56764871   -5.00421733
 H                 -3.88657546    2.03722283   -3.27923490
 H                 -3.26366520    1.34954450   -0.95855595
 H                 -1.98282862   -0.70854847   -0.56553818
 C                 -1.09384158   -2.57234352   -2.36761546
 H                 -0.32898287   -2.69138057   -3.14889387
 C                 -2.05294248   -3.77710714   -2.39169851
 H                 -2.74095579   -3.73086760   -1.53374904
 H                 -1.48613425   -4.71983827   -2.32221772
 H                 -2.64698148   -3.79017848   -3.31777378
 N                 -0.36891817   -2.58323930   -1.10124102
 H                 -0.92472672   -2.80956868   -0.24409776
 C                  0.93276413   -2.24196148   -1.05209109
 O                  1.58370842   -1.85597240   -2.02466870
 C                  1.64206448   -2.36603378    0.29151946
 C                  1.05794081   -2.85910936    1.47004868
 H                  0.01244974   -3.18436872    1.50526124
 C                  2.99056249   -1.98199545    0.30062547
 H                  3.43863943   -1.61310458   -0.62127100
 C                  3.73333572   -2.08679279    1.47465358
 N                  5.15927754   -1.69271070    1.46772812
 O                  5.63478520   -1.30539875    0.41384212
 O                  5.77527420   -1.78631120    2.51903480
 C                  3.18106939   -2.56262065    2.66061204
 H                  3.76828920   -2.63997899    3.57276944
 C                  1.84152661   -2.94031295    2.62515413
 N                  1.23695216   -3.45733453    3.87651434
 O                  1.96726813   -3.56083733    4.85162257
 O                  0.05493390   -3.74922883    3.85762235
 C                  1.48996174    1.84896757   -0.93865384
 C                  2.15082414    2.59588104   -1.89508520
 C                  2.18917950    4.01286894   -1.79019305
 C                  1.55527710    4.64393894   -0.73100588
 C                  0.87172641    3.89634192    0.25993819
 C                  0.19382663    4.51072373    1.35386374
 C                 -0.45474251    3.75470800    2.30428101
 H                 -0.99495024    4.24535351    3.11733933
 H                  0.18900944    5.60293729    1.42304775
 H                  1.58974233    5.73474075   -0.67357488
 O                  2.82458552    4.81780745   -2.69364148
 C                  3.49089899    4.23510149   -3.78644400
 H                  4.30489273    3.55716761   -3.46790740
 H                  2.80402587    3.66967026   -4.44350441
 H                  3.92857014    5.06235505   -4.36414956
 H                  2.63146232    2.08154133   -2.72757244
 H                  1.46077833    0.76165833   -1.04633742
 C                  0.84141487    2.46348082    0.16582694
 C                  0.16717828    1.71276736    1.17181108
 H                  0.13416116    0.62330459    1.08491756
 C                 -0.46191832    2.32845156    2.23874567
 C                 -1.16243478    1.51130419    3.31955082
 C                 -2.68290946    1.77602920    3.24606412
 O                 -3.19450702    2.72226191    3.80779189
 O                 -3.38330201    0.93134867    2.50592343
 H                 -2.83308608    0.14290854    2.15711968
 C                 -3.46902094   -2.59423564    2.81322159
 H                 -4.08064929   -1.71636927    3.06667199
 H                 -2.92044043   -2.91034944    3.71694855
 H                 -4.10486779   -3.43479477    2.50004270
 C                 -2.44042011   -2.27401614    1.72980758
 O                 -2.00594294   -3.22760203    1.03691187
 O                 -2.04562508   -1.07314163    1.61413397
 C                 -0.93147943    0.03331916    2.99842797
 H                 -1.85543199   -0.49922793    3.08563620
 H                 -0.21898901   -0.37376096    3.68511798
 H                 -0.55849992   -0.06067733    1.99995366
 H                 -0.79516389    1.72209639    4.30218948
