81

 C                  1.00881100    0.76734700   -2.16676100
 C                  2.08596000    1.62816200   -2.28956900
 C                  3.39101100    1.15550400   -2.57949900
 C                  3.61876700   -0.19203200   -2.73798500
 C                  2.54887000   -1.12372700   -2.62459700
 C                  1.21991400   -0.64723700   -2.34640500
 C                  2.77178800   -2.52085500   -2.78324200
 C                  1.73665700   -3.42448900   -2.66943700
 C                  0.42463700   -2.96228900   -2.40506300
 C                  0.17355500   -1.61233400   -2.25726400
 C                 -0.38785700    1.29135800   -1.82339100
 N                 -0.75376500    0.86752500   -0.46153000
 C                 -1.87877000    0.18339800   -0.18742200
 C                 -2.08198000   -0.24102400    1.24889800
 O                 -2.71165000   -0.11926000   -1.04681000
 C                 -2.66668800   -1.49534400    1.49179900
 C                 -2.90952100   -1.87807000    2.81138100
 C                 -2.59991300   -1.06836400    3.90127200
 C                 -1.99806300    0.15619600    3.62517000
 C                 -1.73686000    0.58748800    2.32287000
 N                 -3.52637400   -3.20017100    3.08236300
 O                 -3.83873800   -3.44603800    4.23451100
 O                 -3.67875800   -3.94909600    2.13433200
 N                 -1.61245000    1.02010800    4.75754200
 O                 -1.98352900    0.70569700    5.86832800
 O                 -0.93201600    2.01451700    4.50877500
 H                  4.21245000    1.87064800   -2.67556900
 H                  4.62285900   -0.56652100   -2.95647800
 H                  3.78771100   -2.86570300   -2.99679400
 H                  1.92414900   -4.49510500   -2.78720100
 H                 -0.40445900   -3.66771400   -2.30807900
 H                 -0.85367500   -1.30152400   -2.07243400
 H                 -1.11770500    0.80134700   -2.48286600
 H                 -0.08963000    1.09710300    0.28072700
 H                 -2.90001300   -2.17099500    0.66274200
 H                 -2.81262900   -1.38646400    4.92033700
 H                 -1.25322100    1.55090800    2.16780400
 H                  1.94232100    2.70227800   -2.16311700
 C                 -6.80045000   -5.51948300    1.76198400
 C                 -7.87531400   -5.93585900    2.50903600
 C                 -6.93272000   -5.26456600    0.36313500
 C                 -8.21870000   -5.44361200   -0.24307300
 C                 -9.32071000   -5.87742900    0.55037300
 C                 -9.15270100   -6.12258300    1.90261100
 C                 -5.83569000   -4.84128800   -0.43455600
 C                 -5.98147800   -4.58228400   -1.78820100
 C                 -7.26333100   -4.75314500   -2.37894500
 C                 -8.34577500   -5.17359600   -1.63369300
 C                 -4.79389200   -4.18120300   -2.66460000
 C                 -3.95860000   -3.11420000   -1.96477700
 O                 -4.41069600   -1.88405400   -2.16933900
 O                 -2.98885800   -3.36377800   -1.26884400
 O                -10.13150400   -6.53970600    2.74712800
 C                -11.42797200   -6.75234000    2.23969100
 H                 -5.82682600   -5.36751000    2.23552400
 H                 -7.78588700   -6.13349600    3.57967600
 H                -10.28852300   -6.00778700    0.06402800
 H                 -4.86252100   -4.71904800    0.04700300
 H                 -7.38961400   -4.54662600   -3.44617800
 H                 -9.32215000   -5.30008600   -2.11121300
 H                 -3.83028200   -1.24022000   -1.68755700
 H                -11.44087800   -7.53588500    1.45932400
 H                -12.04766600   -7.08127900    3.08503000
 H                -11.86077000   -5.82713400    1.81601400
 C                 -0.57721200    2.80569300   -1.96523300
 H                 -0.31369500    3.14342500   -2.97918000
 H                  0.03563200    3.36298200   -1.23943200
 H                 -1.63163500    3.06078100   -1.78206400
 C                  1.91928500    2.20621200    2.37407500
 O                  0.98620900    1.97543600    1.62534400
 O                  1.76418700    2.39782700    3.67962900
 H                  0.81448400    2.30870100    3.91684800
 C                  3.35684600    2.30296100    1.93822500
 H                  3.43316600    2.15422900    0.85465500
 H                  3.95275500    1.54223800    2.46656100
 H                  3.76521200    3.28558200    2.22159100
 C                 -5.36269073   -3.52589145   -3.93685579
 H                 -4.56979393   -3.05790592   -4.48202017
 H                 -5.82281963   -4.27389180   -4.54814694
 H                 -6.09066280   -2.79056293   -3.66436977
 H                 -4.19235176   -5.02429009   -2.93340010
