81

 C                  1.36795200    1.11495200   -1.67506000
 C                  2.48101700    1.93752100   -1.70283000
 C                  3.78749200    1.41823500   -1.88459000
 C                  3.97774900    0.06377700   -2.03052600
 C                  2.86979600   -0.82986400   -2.01165500
 C                  1.54044100   -0.30679300   -1.84301200
 C                  3.05474600   -2.23387600   -2.15741100
 C                  1.98146200   -3.09939800   -2.13539700
 C                  0.66938700   -2.59063300   -1.97976000
 C                  0.45601900   -1.23267700   -1.84584600
 C                 -0.03030200    1.68450100   -1.44033300
 N                 -0.50910700    1.26418600   -0.10959100
 C                 -1.69602800    0.65003200    0.09030600
 C                 -1.97237900    0.18146000    1.49713800
 O                 -2.51114400    0.46650200   -0.81291800
 C                 -2.53864600   -1.09132500    1.67944000
 C                 -2.84300200   -1.50596000    2.97506300
 C                 -2.61881700   -0.70867700    4.09641900
 C                 -2.04884400    0.54082400    3.88037400
 C                 -1.71886500    0.99975400    2.60417000
 N                 -3.44182600   -2.84807100    3.18237600
 O                 -3.83308100   -3.11889000    4.30329000
 O                 -3.50221600   -3.58659000    2.21464500
 N                 -1.78625600    1.41866000    5.04664400
 O                 -2.09575700    0.99565500    6.14520500
 O                 -1.27465400    2.50295200    4.82209300
 H                  4.63942600    2.10263600   -1.90336800
 H                  4.98272300   -0.34636300   -2.16409100
 H                  4.07185400   -2.61552100   -2.28568200
 H                  2.13944100   -4.17595500   -2.24158000
 H                 -0.19092100   -3.26389300   -1.95737100
 H                 -0.57212100   -0.88738100   -1.74569000
 H                 -0.72794600    1.21435600   -2.14812000
 H                  0.16044600    1.29048400    0.65260700
 H                 -2.71375700   -1.75147500    0.82395300
 H                 -2.87920600   -1.04868900    5.09719100
 H                 -1.29180700    1.99810300    2.50243200
 H                  2.36607200    3.01611000   -1.58424400
 C                 -6.61332500   -5.11751900    1.62996100
 C                 -7.70098100   -5.58970300    2.32311000
 C                 -6.70864700   -4.80119600    0.24073000
 C                 -7.97185700   -4.97712000   -0.41285000
 C                 -9.08741200   -5.46996600    0.32499900
 C                 -8.95485200   -5.77517600    1.66895000
 C                 -5.59674000   -4.32291100   -0.50310900
 C                 -5.70646700   -4.00785700   -1.84846600
 C                 -6.96653200   -4.17398000   -2.48539200
 C                 -8.06265700   -4.64623300   -1.79298900
 C                 -4.49988400   -3.55187000   -2.67061100
 C                 -3.70641400   -2.50062200   -1.90328500
 C                 -3.60429600   -4.73134200   -3.08005800
 O                 -4.18210400   -1.27213600   -2.06241200
 O                 -2.74685600   -2.75852500   -1.19584100
 O                 -9.94842700   -6.25371700    2.46123400
 C                -11.21929800   -6.48622000    1.89978900
 H                 -5.65764000   -4.97021100    2.14018200
 H                 -7.63926200   -5.83533400    3.38565300
 H                -10.03696700   -5.59724600   -0.19651600
 H                 -4.64079600   -4.20629300    0.01383500
 H                 -7.06451100   -3.92289400   -3.54601500
 H                 -9.02161900   -4.76838700   -2.30547500
 H                 -4.88710200   -3.05261300   -3.57252100
 H                 -2.77599600   -4.39741200   -3.72606200
 H                 -3.17071100   -5.21184500   -2.19107100
 H                 -4.19238600   -5.48154100   -3.63023400
 H                 -3.62934100   -0.64012300   -1.53767500
 H                -11.17813000   -7.23377400    1.08598900
 H                -11.85506300   -6.87356300    2.70792400
 H                -11.67022000   -5.55823000    1.50249100
 C                 -0.16983400    3.20151500   -1.60074500
 H                  0.16441200    3.52164100   -2.59918400
 H                  0.41256700    3.75438700   -0.84678000
 H                 -1.22639400    3.48569100   -1.48529500
 C                  2.24419990    1.37232750    3.02468666
 O                  1.80953613    1.71403638    4.34347491
 H                  0.86544094    1.88784141    4.33475127
 O                  1.41397070    1.33971863    2.07957995
 C                  3.67857410    1.05611353    2.77432817
 H                  3.81711667    0.82353821    1.73913994
 H                  3.96791408    0.21599046    3.37046206
 H                  4.28074552    1.90173199    3.03359443
