80

 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                 -2.17010043   -4.43635668   -6.94930252
 C                 -1.63040042   -5.53041036   -7.58061760
 C                 -3.35869242   -4.55226802   -6.16631453
 C                 -3.97145492   -5.84192038   -6.04544649
 C                 -3.39544489   -6.96400218   -6.70976920
 C                 -2.24644534   -6.81178874   -7.46707113
 C                 -3.94264494   -3.43557350   -5.50985219
 C                 -5.08783171   -3.56501457   -4.74012218
 C                 -5.68321627   -4.85027486   -4.61788352
 C                 -5.14666590   -5.95206061   -5.25195485
 C                 -5.75401398   -2.35841406   -4.07708518
 C                 -4.70498982   -1.48329814   -3.39908754
 C                 -6.58992690   -1.54299089   -5.07577834
 O                 -4.41069600   -1.88405400   -2.16933900
 O                 -4.17210496   -0.52745247   -3.93705059
 O                 -1.61836500   -7.81030104   -8.14067646
 C                 -2.15301523   -9.11221476   -8.08867057
 H                 -1.68637066   -3.45934481   -7.03135692
 H                 -0.72152623   -5.45359699   -8.18176233
 H                 -3.88265601   -7.93427387   -6.60306943
 H                 -3.46305884   -2.46026088   -5.62237797
 H                 -6.58506324   -4.96356585   -4.00844036
 H                 -5.62414092   -6.93076657   -5.14478472
 H                 -6.40557283   -2.74184361   -3.27662881
 H                 -7.12135367   -0.71975208   -4.57111006
 H                 -5.94333798   -1.10626263   -5.85048437
 H                 -7.33535390   -2.18855013   -5.56500981
 H                 -3.72378623   -1.27992365   -1.78632723
 H                 -3.17608790   -9.15375149   -8.50661673
 H                 -1.49424671   -9.74833096   -8.69546522
 H                 -2.17921963   -9.50519018   -7.05537191
 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
