81

 C                  1.30835400    0.76408600   -1.78592100
 C                  1.69807500    2.04401200   -2.15013500
 C                  3.06255000    2.43561200   -2.17091600
 C                  4.04421200    1.53617600   -1.82292700
 C                  3.70446500    0.20482000   -1.45238300
 C                  2.32255300   -0.19784600   -1.43333600
 C                  4.71346100   -0.73799700   -1.10701500
 C                  4.38737500   -2.03146400   -0.76103400
 C                  3.03043900   -2.43526700   -0.74946500
 C                  2.02494200   -1.54617700   -1.07413400
 C                 -0.17152200    0.37041200   -1.75058400
 N                 -0.64495500    0.26850400   -0.36385400
 C                 -1.20077300   -0.86505700    0.12751800
 C                 -1.74062700   -0.81611600    1.54393200
 O                 -1.27045800   -1.91583200   -0.50318600
 C                 -1.95587500   -2.05692400    2.16490200
 C                 -2.48502900   -2.10244800    3.45073000
 C                 -2.82795000   -0.95429900    4.15835600
 C                 -2.61861800    0.26291300    3.51430200
 C                 -2.08098200    0.35907500    2.22517000
 N                 -2.71180100   -3.42114300    4.09092600
 O                 -3.37290900   -3.43689800    5.11338300
 O                 -2.22755700   -4.39606200    3.54264200
 N                 -2.98786700    1.50421400    4.21577300
 O                 -3.33923300    1.42451200    5.38838500
 O                 -2.93449200    2.54950100    3.59277100
 H                  3.32418700    3.45489000   -2.46650800
 H                  5.09788500    1.82818200   -1.83564300
 H                  5.75824300   -0.41514300   -1.12444000
 H                  5.17132300   -2.74664700   -0.49846300
 H                  2.77302500   -3.46332000   -0.48097600
 H                  0.99145700   -1.89522900   -1.05361100
 H                 -0.26832500   -0.64356100   -2.16184400
 H                 -0.55726600    1.11157700    0.20524000
 H                 -1.71271400   -2.97470200    1.62994300
 H                 -3.21684200   -1.01788300    5.17097300
 H                 -1.94026500    1.34963100    1.79020700
 H                  0.94548400    2.77709500   -2.44477000
 C                 -0.40272700    3.63465700    6.65281600
 C                  0.13107400    3.41793300    7.89887900
 C                  0.38446400    4.18603300    5.59989900
 C                  1.75168400    4.51628800    5.87069000
 C                  2.28823900    4.28624300    7.17089300
 C                  1.49370400    3.74165900    8.16697700
 C                 -0.14763500    4.40519500    4.30176400
 C                  0.62570900    4.93464900    3.28315700
 C                  1.98387800    5.26016000    3.55783100
 C                  2.52784900    5.06164500    4.80975600
 C                  0.06922700    5.13706400    1.87015500
 C                  0.38237100    3.88446200    1.05832800
 O                  1.61469400    3.90506200    0.54652500
 O                 -0.38287600    2.95195300    0.89612900
 O                  1.90631100    3.46365600    9.43014500
 C                  3.23315200    3.76518700    9.80120000
 H                 -1.44552200    3.37380400    6.45428000
 H                 -0.47226500    2.99235000    8.70249100
 H                  3.33314400    4.54096600    7.35288200
 H                 -1.19180300    4.13889800    4.12707200
 H                  2.60479700    5.67269700    2.75760500
 H                  3.57285000    5.32482800    4.99850400
 H                  1.77385900    3.08114400    0.04434700
 H                  3.44960700    4.84479100    9.70361300
 H                  3.33939200    3.47375900   10.85508700
 H                  3.96723600    3.20102900    9.19711500
 C                 -1.10560000    1.28587000   -2.55275200
 H                 -0.77020000    1.38176400   -3.59701200
 H                 -1.17163200    2.29263300   -2.11110700
 H                 -2.11935800    0.85806200   -2.55584200
 C                 -1.41037200   -0.17859700    7.90475000
 O                 -1.36365000   -0.89109100    6.92785700
 O                 -2.19668600    0.90820700    7.97889600
 H                 -2.65404200    1.01165200    7.11930400
 C                 -0.60489800   -0.37974300    9.16375800
 H                 -0.10202900   -1.35363800    9.13017000
 H                 -1.25615100   -0.31117500   10.04818900
 H                  0.14733400    0.42203800    9.24833500
 H                 -0.97437776    5.36916382    1.82635106
 C                  0.87904236    6.27482227    1.22107472
 H                  0.54222888    6.42422532    0.21651740
 H                  0.74057609    7.17580025    1.78140120
 H                  1.91698582    6.01496123    1.21432141
