83

 C                  3.34069000    0.45776500   -1.81001700
 C                  3.90492800    1.62467000   -1.32350300
 C                  4.91771500    1.60983300   -0.33215200
 C                  5.37640000    0.41332100    0.16866700
 C                  4.83814000   -0.81852600   -0.29857300
 C                  3.79964300   -0.80746800   -1.29529600
 C                  5.31422900   -2.06287700    0.20294400
 C                  4.79338800   -3.25695000   -0.24747000
 C                  3.76526100   -3.25171900   -1.22111400
 C                  3.27945200   -2.06317200   -1.73007100
 C                  2.23521900    0.50324000   -2.86746200
 N                  0.91541800    0.33359500   -2.24549800
 C                  0.07066200   -0.67341700   -2.57478000
 C                 -1.29362800   -0.65184700   -1.91340600
 O                  0.35491100   -1.58461700   -3.34528900
 C                 -2.00790000   -1.85867500   -1.89237300
 C                 -3.26740500   -1.89906800   -1.29847300
 C                 -3.86320500   -0.77391900   -0.73264900
 C                 -3.14342500    0.41563100   -0.79243800
 C                 -1.87596000    0.50029000   -1.37124200
 N                 -4.00686900   -3.18490700   -1.25870400
 O                 -5.11122500   -3.17663500   -0.74195700
 O                 -3.45957100   -4.15984000   -1.74206100
 N                 -3.73923300    1.63352400   -0.20308800
 O                 -4.76031900    1.50582600    0.44766700
 O                 -3.16166400    2.69404100   -0.39840400
 H                  5.33664800    2.55489600    0.02399000
 H                  6.16264700    0.39060100    0.92872800
 H                  6.10850700   -2.05332900    0.95531800
 H                  5.16972600   -4.20582500    0.14420700
 H                  3.35002800   -4.19851300   -1.57646400
 H                  2.47785300   -2.09997900   -2.46971500
 H                  2.35229800   -0.36292400   -3.53052700
 H                  0.64248700    1.04458800   -1.56928600
 H                 -1.57252700   -2.75185700   -2.34003900
 H                 -4.84523900   -0.82456400   -0.26657400
 H                 -1.37116200    1.46565400   -1.38259100
 H                  3.57018900    2.58966900   -1.70777100
 C                 -0.15542800   -0.11335400    3.17244100
 C                 -1.38447800    0.56425100    3.12581700
 C                 -1.50356400    1.80674300    2.49765300
 C                 -0.39600900    2.42138200    1.89397100
 C                  0.83518800    1.74887300    1.93958900
 C                  0.95004600    0.50505800    2.56513800
 C                 -0.04289900   -1.46501100    3.84335500
 C                 -0.55023800   -2.66287700    3.00142600
 C                 -0.59359800   -3.93564300    3.85668500
 C                  0.28339000   -2.87720300    1.73302600
 C                 -0.53083800    3.80907600    1.29338300
 C                 -0.05503000    3.89704300   -0.15132600
 O                  0.29381000    2.97558100   -0.86212500
 O                 -0.08744700    5.15511900   -0.61371200
 H                 -2.26552200    0.11750600    3.59746800
 H                 -2.47534300    2.30999200    2.48454400
 H                  1.72147700    2.19249900    1.47822700
 H                  1.92316700    0.00646100    2.58357100
 H                 -0.61497700   -1.44136300    4.78678000
 H                  1.00932700   -1.65162500    4.12256400
 H                 -1.58700600   -2.42893700    2.69227000
 H                 -0.97944700   -4.79161900    3.27932800
 H                 -1.23943800   -3.80879600    4.74142900
 H                  0.41470300   -4.20586200    4.21676900
 H                  1.33025100   -3.12334300    1.98350200
 H                  0.29961000   -1.98034900    1.09425700
 H                 -0.11675700   -3.71010100    1.13193600
 H                  0.17850900    5.12721500   -1.54940300
 C                  2.23208700    1.76240900   -3.74455700
 H                  3.22215500    1.93533600   -4.19362700
 H                  1.94352200    2.65557900   -3.16954600
 H                  1.50002300    1.63989300   -4.55773600
 C                  0.12271800    4.89465600    2.17739600
 H                 -0.04919000    5.89906800    1.76602600
 H                  1.20883600    4.73394600    2.26547200
 H                 -0.30551200    4.84995900    3.18922300
 H                 -1.60777500    4.04292500    1.21724100
 O                  1.10650999   -3.99262370   -5.37855976
 H                  0.88441727   -3.28027106   -4.77454937
 C                  2.47397417   -3.73407091   -5.70733345
 C                  3.17265025   -4.61045874   -6.61143307
 H                  2.51434643   -5.39075440   -6.93186211
 H                  4.01676384   -5.03849464   -6.11227625
 H                  3.50599531   -4.05333235   -7.46195717
 O                  3.06887302   -2.74330751   -5.20928344
