81

 C                  1.45451000    1.06943100   -1.49533300
 C                  2.65951100    1.74951100   -1.44881300
 C                  3.87881200    1.13959800   -1.83991400
 C                  3.89003500   -0.16562900   -2.27586700
 C                  2.68124600   -0.91485400   -2.34368400
 C                  1.44091500   -0.29661900   -1.95652500
 C                  2.67979000   -2.26711800   -2.78909700
 C                  1.51126400   -2.99723100   -2.84254400
 C                  0.28716100   -2.39463800   -2.46392400
 C                  0.25126400   -1.07874900   -2.04526500
 C                  0.14939700    1.73964000   -1.05823700
 N                 -0.33718100    1.14904500    0.19604100
 C                 -1.57674900    0.61426100    0.30372700
 C                 -1.96014700    0.04924800    1.65619800
 O                 -2.37910900    0.54147100   -0.61978500
 C                 -2.87825800   -1.01275000    1.66222600
 C                 -3.31090900   -1.52600500    2.88409500
 C                 -2.87126500   -1.02514500    4.10901200
 C                 -1.96568800    0.03068300    4.06677800
 C                 -1.50260200    0.57795100    2.86732100
 N                 -4.28172700   -2.64333700    2.90536000
 O                 -4.53345700   -3.15071000    3.98023800
 O                 -4.78293200   -2.98706300    1.84323500
 N                 -1.47663700    0.58736500    5.34408700
 O                 -1.89670100    0.10595100    6.37567400
 O                 -0.67260500    1.51539200    5.28996700
 H                  4.80684400    1.71618200   -1.79544500
 H                  4.82571100   -0.64445100   -2.57920900
 H                  3.63082000   -2.71969100   -3.08529100
 H                  1.52728700   -4.03780600   -3.17809400
 H                 -0.64526800   -2.96410700   -2.48421400
 H                 -0.71722400   -0.65277600   -1.78312700
 H                 -0.62591200    1.50251200   -1.80026500
 H                  0.30015500    1.16893800    0.99221400
 H                 -3.21348300   -1.43684500    0.71353100
 H                 -3.22036200   -1.44193000    5.05180600
 H                 -0.77946300    1.39256700    2.89787000
 H                  2.68712100    2.78512000   -1.10678100
 C                  5.23352800   -1.87670100    6.07587700
 C                  5.78571300   -3.11836300    6.27001000
 C                  5.08049000   -1.33238200    4.76546500
 C                  5.51626400   -2.11836200    3.64873800
 C                  6.08929000   -3.40433000    3.87073700
 C                  6.22380700   -3.89763200    5.15766900
 C                  4.51541400   -0.05051100    4.53886600
 C                  4.37489300    0.46551300    3.25963700
 C                  4.79971300   -0.32484200    2.15647800
 C                  5.35424800   -1.57454100    2.34499800
 C                  3.77955600    1.85300300    3.01002600
 C                  2.30155600    1.84724100    3.37778900
 O                  2.07406500    1.96162500    4.68342300
 O                  1.40428200    1.73206400    2.56176300
 O                  6.75596600   -5.10247400    5.47952800
 C                  7.22862400   -5.94185600    4.44977100
 H                  4.90328000   -1.28596800    6.93508400
 H                  5.90622600   -3.54301200    7.26900800
 H                  6.41541700   -3.98229700    3.00541700
 H                  4.17759600    0.52685900    5.40319000
 H                  4.68051200    0.06516800    1.14151800
 H                  5.67395000   -2.16389500    1.48079900
 H                  1.11194300    1.87553600    4.86129300
 H                  8.04285500   -5.46468500    3.87403400
 H                  7.61819400   -6.84697500    4.93558600
 H                  6.42150000   -6.22819200    3.75086100
 C                  0.21240100    3.26586500   -0.92317000
 H                  0.56553800    3.73497400   -1.85432600
 H                  0.87674600    3.57461200   -0.10087600
 H                 -0.79381300    3.65377100   -0.70335200
 C                 -4.15701400   -3.04844300   -1.70948900
 O                 -3.08039200   -2.80817700   -1.20573800
 O                 -5.28117400   -3.18425900   -0.99637700
 H                 -5.06477500   -3.07863500   -0.04797300
 C                 -4.40187600   -3.21209600   -3.18862200
 H                 -4.95750100   -4.14187300   -3.38359400
 H                 -3.44895300   -3.21106700   -3.73065400
 H                 -5.02806100   -2.37817300   -3.54482300
 C                  3.79421301    2.09620873    1.48942213
 H                  3.33145616    3.03664373    1.27415921
 H                  4.80542508    2.10796717    1.13983396
 H                  3.25594152    1.31299580    0.99775017
 H                  4.31890712    2.63857346    3.49672861
