 46 
 
   C    0.980869865    1.416790016   -0.947825634 
   C    1.703915416    2.643330578   -0.853237310 
   C    2.426990234    3.107567036   -1.960626536 
   C    2.481779038    2.378374092   -3.140539567 
   C    1.815207478    1.159998381   -3.259919405 
   C    1.054542444    0.649431178   -2.174155164 
   C    1.916596441    0.455932986   -4.472567658 
   C    1.281176035   -0.767432171   -4.651630834 
   C    0.534628196   -1.299233464   -3.615588664 
   C    0.424034186   -0.603813914   -2.406004322 
   C    1.711669171    3.537005988    0.362234738 
   C    0.163249272    0.880443332    0.237293689 
   N    1.046051905    0.353459523    1.269206020 
   C   -0.838098755    1.870576533    0.798675009 
   C   -0.979455049    2.306828867    2.060459463 
   C    0.789700065   -0.579902311    2.234516337 
   C   -0.412757421   -1.423206524    2.138357874 
   O    1.535079561   -0.730814122    3.195525563 
   C   -0.530552113   -2.354730532    1.104087704 
   C   -1.670218134   -3.165883172    1.048348262 
   C   -2.672812916   -3.073685466    2.023885483 
   C   -2.516824497   -2.150676492    3.068868843 
   C   -1.386424827   -1.326471881    3.136768735 
   N   -1.819403133   -4.115935095   -0.058039979 
   O   -2.641436341   -5.030169623    0.079495870 
   O   -1.121564506   -3.930291362   -1.064288182 
   N   -3.555274735   -2.040221759    4.101697861 
   O   -3.441558234   -1.132684263    4.935731503 
   O   -4.485172318   -2.856556341    4.066367400 
   H    2.964047329    4.053623180   -1.911852135 
   H    3.061815754    2.777220294   -3.970518201 
   H    2.502555776    0.859272389   -5.296555141 
   H    1.372769984   -1.300625028   -5.593717046 
   H    0.035198265   -2.258071426   -3.737026360 
   H   -0.177060911   -1.091235062   -1.648396553 
   H    0.797672987    4.137068943    0.395822389 
   H    1.826931344    2.972462931    1.288934292 
   H    2.558769394    4.232584496    0.334026073 
   H   -0.474693160    0.062643275   -0.091380759 
   H    1.894142968    0.874909991    1.446204056 
   H   -1.535818685    2.261462817    0.057021698 
   H   -1.755630527    3.024395445    2.312122830 
   H   -0.327724720    1.987694291    2.867663009 
   H    0.267532786   -2.446250353    0.369008201 
   H   -3.556321379   -3.709426103    1.970750326 
   H   -1.248139632   -0.615757466    3.950794099 
