82

 C                  3.42880400    0.59064800   -1.85609500
 C                  4.01319500    1.75333200   -1.38433200
 C                  4.98599700    1.73664600   -0.35326300
 C                  5.37545900    0.54329600    0.20946800
 C                  4.81218000   -0.68452700   -0.23900900
 C                  3.82629600   -0.67259600   -1.28722300
 C                  5.21122800   -1.92568400    0.33289600
 C                  4.66752900   -3.11617300   -0.09991700
 C                  3.69970200   -3.11107400   -1.13330600
 C                  3.29120300   -1.92515300   -1.71176300
 C                  2.35468900    0.63511600   -2.94487300
 N                  1.02833900    0.40934400   -2.34920800
 C                  0.19468600   -0.57254000   -2.74697600
 C                 -1.13956600   -0.64055000   -2.04356800
 O                  0.49938800   -1.39241200   -3.61789400
 C                 -1.74712300   -1.89534900   -1.86118700
 C                 -2.96802700   -1.95084100   -1.18696800
 C                 -3.62429700   -0.81762000   -0.71298900
 C                 -2.99827300    0.40758300   -0.91863300
 C                 -1.77276800    0.51678900   -1.57368100
 N                 -3.59642600   -3.26914600   -0.92571100
 O                 -4.78336400   -3.26996100   -0.64070800
 O                 -2.88366900   -4.25217900   -0.99817900
 N                 -3.63662300    1.63208900   -0.39370500
 O                 -4.65273400    1.50147700    0.26516900
 O                 -3.09691200    2.70142500   -0.64169900
 H                  5.42387900    2.67831700   -0.01167000
 H                  6.12507900    0.51974600    1.00565900
 H                  5.96360900   -1.91646700    1.12698800
 H                  4.98192800   -4.06228300    0.34867500
 H                  3.26859800   -4.05435500   -1.47882800
 H                  2.54401400   -1.96412100   -2.50534900
 H                  2.51205100   -0.20983700   -3.62733300
 H                  0.74732900    1.06184900   -1.61721000
 H                 -1.28537700   -2.81317300   -2.24448100
 H                 -4.57970000   -0.89049600   -0.19682400
 H                 -1.33266000    1.50460400   -1.69911100
 H                  3.72440100    2.71655500   -1.80739000
 C                 -0.15132900   -0.30290900    2.96902800
 C                 -1.37268300    0.39094300    2.97399400
 C                 -1.48784800    1.66005300    2.40070700
 C                 -0.38336400    2.28889200    1.80494700
 C                  0.83980500    1.60066000    1.79986300
 C                  0.94939300    0.32845500    2.36746800
 C                 -0.03853500   -1.67953800    3.58857900
 C                 -0.72613500   -2.81762600    2.79457400
 C                 -0.73653600   -4.11473000    3.61306600
 C                 -0.08505500   -3.03636700    1.41940100
 C                 -0.51262900    3.70156200    1.26518600
 C                 -0.09934900    3.84491100   -0.19417700
 O                  0.34214800    2.97721400   -0.92129800
 O                 -0.28891400    5.09481400   -0.63841000
 H                 -2.25120700   -0.06362900    3.44237500
 H                 -2.45424900    2.17337800    2.42584200
 H                  1.72362000    2.05526900    1.34496900
 H                  1.91611000   -0.18303400    2.34583200
 H                 -0.48027600   -1.64966300    4.60026300
 H                  1.02724400   -1.93502800    3.72315200
 H                 -1.77845600   -2.51405900    2.63477500
 H                 -1.24956500   -4.92396800    3.06870300
 H                 -1.24874100   -3.98162000    4.58053700
 H                  0.29191800   -4.45644000    3.82418200
 H                  0.95475000   -3.39389900    1.51905800
 H                 -0.05679500   -2.10575800    0.83145900
 H                 -0.64365500   -3.78510400    0.83513200
 H                 -0.03978000    5.11258800   -1.57874000
 C                  2.32919000    1.91594900   -3.78773300
 H                  3.31897500    2.12256100   -4.22247500
 H                  2.01429300    2.78517000   -3.19067200
 H                  1.60902500    1.79743200   -4.61184000
 C                  0.22258000    4.73749400    2.14811100
 H                  0.05636100    5.75996900    1.78027800
 H                  1.30686400    4.54410700    2.16841900
 H                 -0.14964600    4.66946200    3.18064500
 H                 -1.58286900    3.97163300    1.25863300
 O                  0.26256000   -3.53676700   -5.21752700
 C                 -0.31814100   -4.57020800   -4.61237500
 C                 -0.32982600   -5.80855600   -5.47815900
 H                  0.70108400   -6.08277000   -5.75239800
 H                 -0.86787400   -5.60068600   -6.41664800
 H                 -0.81208800   -6.63494000   -4.94252200
 O                 -0.78614600   -4.52054400   -3.49328400
