81

 C                  2.36271700    3.73719400   -0.78736000
 C                  1.89931800    5.01195200   -1.06381000
 C                  1.67477700    5.96344000   -0.03771200
 C                  1.92246500    5.63462000    1.27469100
 C                  2.40564200    4.34046100    1.61788200
 C                  2.62854100    3.36895600    0.58031800
 C                  3.11243400    2.08391100    0.96400900
 C                  3.37059800    1.77874800    2.28592100
 C                  3.15059600    2.74023200    3.30187900
 C                  2.67664800    3.99214600    2.97134900
 H                  2.50362300    4.74282200    3.74808600
 H                  3.35849000    2.48705800    4.34483200
 H                  3.74903900    0.78499100    2.53415100
 H                  3.28881400    1.31271500    0.21321000
 H                  1.75460800    6.36328800    2.07285600
 H                  1.30679500    6.95863700   -0.30003600
 H                  1.70113400    5.30834300   -2.09541900
 C                  2.56667500    2.71491600   -1.90252300
 H                  3.46233100    2.11967400   -1.67852400
 C                  2.75612300    3.29797400   -3.30851400
 H                  1.85107100    3.80915400   -3.67244200
 H                  2.98644700    2.48350900   -4.01173100
 H                  3.59181700    4.01460200   -3.32647000
 N                  1.45424800    1.75205400   -1.89084900
 H                  0.53336400    2.11689300   -1.67751100
 C                  1.62900500    0.41493900   -2.04738900
 O                  2.73095700   -0.10806400   -2.16934900
 C                  0.37293900   -0.43056800   -2.04123900
 C                 -0.90912600    0.08679900   -2.26631900
 H                 -1.09040100    1.13626600   -2.49804900
 C                  0.52735500   -1.80713300   -1.81578200
 H                  1.52311600   -2.23120100   -1.68505300
 C                 -0.60317100   -2.61657100   -1.74022200
 N                 -0.44028700   -4.06026500   -1.44902700
 O                 -1.43194100   -4.66506800   -1.07323000
 O                  0.66393000   -4.54107100   -1.61353100
 C                 -1.89156900   -2.12180800   -1.92319000
 H                 -2.76340400   -2.76777800   -1.84827800
 C                 -2.01227600   -0.76495800   -2.20818200
 N                 -3.35862300   -0.19987600   -2.43695000
 O                 -4.31561300   -0.93975800   -2.28206000
 O                 -3.42710600    0.97601700   -2.75863700
 C                 -1.98935900    1.71166300    2.05436800
 C                 -2.85989100    2.58301900    1.44604100
 C                 -3.99963800    2.09558400    0.73684200
 C                 -4.24566500    0.73388500    0.67923100
 C                 -3.34945700   -0.18633700    1.29588100
 C                 -3.54064200   -1.59256100    1.22157600
 C                 -2.62985400   -2.47086100    1.77563900
 H                 -2.80181700   -3.54268400    1.67178600
 H                 -4.41932100   -1.97844700    0.69726900
 H                 -5.10704100    0.33581500    0.14254200
 O                 -4.76443200    3.04737900    0.15385500
 C                 -5.84935800    2.64669200   -0.66193200
 H                 -6.29021200    3.56793300   -1.06635700
 H                 -5.50970600    2.00668500   -1.49458500
 H                 -6.61940500    2.10759700   -0.08050800
 H                 -2.70436300    3.66377100    1.47811100
 H                 -1.11433800    2.09652900    2.58588100
 C                 -2.19425600    0.29990700    1.99176600
 C                 -1.28844300   -0.62797200    2.56770300
 H                 -0.40697700   -0.23989000    3.08646900
 C                 -1.47779900   -1.99909500    2.46172000
 C                 -0.43585600   -2.96088700    3.05253600
 C                  0.86559700   -2.76056000    2.28278100
 O                  1.10025400   -3.34295700    1.22588500
 O                  1.68826100   -1.89882300    2.83419300
 H                  2.49488500   -1.74845700    2.24054300
 C                  4.03730500   -2.10417400    0.26504800
 O                  3.32501300   -3.11595900   -0.17849600
 H                  2.49904300   -3.25305300    0.38235600
 C                  5.21486400   -1.76043000   -0.60041800
 H                  5.66712200   -2.66914900   -1.02115200
 H                  5.94940100   -1.17985400   -0.02842900
 H                  4.83375200   -1.14742100   -1.43429700
 O                  3.75206700   -1.47046400    1.28161700
 C                 -0.15446830   -2.51368731    4.48840974
 H                  0.57149216   -3.16469388    4.92894561
 H                 -1.05967063   -2.55166703    5.05767794
 H                  0.22156135   -1.51195381    4.48277896
 H                 -0.71703712   -3.99326505    3.04681448
