81

 C                  1.70536400    0.87280400   -1.47021900
 C                  2.80831400    1.69772800   -1.32962500
 C                  4.12167300    1.24842100   -1.61804000
 C                  4.33233800   -0.04187100   -2.04658000
 C                  3.23634200   -0.93476900   -2.21128900
 C                  1.90064100   -0.48022300   -1.92678200
 C                  3.44045100   -2.26867800   -2.66425200
 C                  2.37904100   -3.13065600   -2.83732900
 C                  1.06241100   -2.68636100   -2.56645100
 C                  0.82724800   -1.39917000   -2.12429300
 C                  0.29582200    1.38143400   -1.15670500
 N                 -0.20286200    0.81994400    0.10794000
 C                 -1.37190000    0.13998100    0.18112400
 C                 -1.86309500   -0.25418900    1.56236600
 O                 -2.04169200   -0.17575700   -0.79757100
 C                 -2.84085500   -1.25923200    1.61468900
 C                 -3.36973700   -1.64001300    2.84547400
 C                 -2.98033100   -1.04469400    4.04220200
 C                 -2.02175700   -0.03770000    3.95898000
 C                 -1.45579200    0.37003200    2.74788500
 N                 -4.39412600   -2.71332300    2.89285100
 O                 -4.84609100   -3.00231000    3.98764700
 O                 -4.71034000   -3.22984500    1.83672500
 N                 -1.59786400    0.62547300    5.20857400
 O                 -2.07126000    0.23231300    6.25378500
 O                 -0.79294700    1.55017600    5.11826300
 H                  4.96249700    1.93788600   -1.50344700
 H                  5.34121800   -0.39697100   -2.27565700
 H                  4.46201600   -2.59766100   -2.87595200
 H                  2.54898700   -4.15259600   -3.18664600
 H                  0.22012100   -3.36842300   -2.71081500
 H                 -0.20176300   -1.09271300   -1.92988800
 H                 -0.38772200    0.99713100   -1.92569900
 H                  0.35031100    1.01757500    0.94185100
 H                 -3.18409900   -1.72557800    0.69128400
 H                 -3.41122500   -1.35243300    4.99305700
 H                 -0.70317500    1.15930500    2.75428200
 H                  2.67749900    2.72794200   -0.99508200
 C                  4.96747500   -1.97493500    5.95071000
 C                  5.56093400   -3.20289300    6.10728400
 C                  4.95569900   -1.31583300    4.68484100
 C                  5.57820500   -1.97237200    3.57295800
 C                  6.19016900   -3.24622900    3.75546500
 C                  6.18477800   -3.85255300    5.00044100
 C                  4.35298500   -0.04440900    4.49770000
 C                  4.35014400    0.58222000    3.26065700
 C                  4.95983000   -0.08105000    2.16090800
 C                  5.55672300   -1.31582000    2.31222700
 C                  3.73069400    1.96681900    3.05555900
 C                  2.23791700    1.90877800    3.34947900
 C                  4.45130800    3.06931700    3.85081800
 O                  1.94280900    2.01878000    4.64111800
 O                  1.38688100    1.75713600    2.48981700
 O                  6.73948000   -5.05654100    5.28419900
 C                  7.39292700   -5.77016800    4.25855700
 H                  4.49435500   -1.48491500    6.80658500
 H                  5.57569500   -3.71444300    7.07215100
 H                  6.65715400   -3.72343300    2.89304100
 H                  3.87749800    0.43527900    5.35735000
 H                  4.94824100    0.39447500    1.17639600
 H                  6.01944700   -1.80560900    1.45068300
 H                  3.79034700    2.19662600    1.98203700
 H                  4.00348200    4.05773800    3.65795300
 H                  4.40270800    2.88017400    4.93275100
 H                  5.51081200    3.10782100    3.55543900
 H                  0.97524200    1.90962400    4.77383900
 H                  8.24276800   -5.20017300    3.84028000
 H                  7.77298400   -6.69592100    4.71195900
 H                  6.70167400   -6.03072500    3.43622100
 C                  0.15037600    2.90849100   -1.13005000
 H                  0.51754700    3.35884400   -2.06501900
 H                  0.69803400    3.35692500   -0.28629400
 H                 -0.91207200    3.17149200   -1.01568800
 C                 -4.50684175   -2.01550749   -2.04424195
 O                 -4.23369054   -2.12937485   -0.82113393
 O                 -3.76319197   -1.11270650   -2.86694200
 H                 -3.09501685   -0.67229127   -2.33668129
 C                 -5.57932381   -2.80242617   -2.62133917
 H                 -6.32302910   -2.14867451   -3.02681569
 H                 -6.01908263   -3.41624795   -1.86322638
 H                 -5.18728538   -3.42304349   -3.39982488
