 43 
 
   C    0.234422241    0.334445903   -1.838999085 
   C    1.449168553    0.851232397   -1.339148901 
   C    2.615176215    0.816384379   -2.096404766 
   C    2.592819540    0.274563293   -3.375595064 
   C    1.406892701   -0.233181255   -3.920796143 
   C    0.205194475   -0.207592586   -3.163857181 
   C    1.416384970   -0.763191397   -5.221978696 
   C    0.255619980   -1.268758519   -5.801405907 
   C   -0.931400425   -1.248792781   -5.085135544 
   C   -0.955814521   -0.726244781   -3.788770400 
   C   -1.033685952    0.406383544   -0.985667446 
   N   -0.773508087    0.474887635    0.443592748 
   C   -1.847521259    1.637119610   -1.309100562 
   C   -3.182040226    1.651650777   -1.440979889 
   C   -0.598574802   -0.665119144    1.192634149 
   C   -0.252753859   -0.470359791    2.625974547 
   O   -0.693999840   -1.803175405    0.752559694 
   C    0.510810503   -1.459654712    3.262466232 
   C    0.840360588   -1.320678106    4.617486996 
   C    0.410528352   -0.206320826    5.350044384 
   C   -0.362284331    0.767756742    4.704579329 
   C   -0.701411427    0.642265607    3.348370043 
   N    1.649560670   -2.353966288    5.277526859 
   O    1.788983482   -2.271125209    6.504925380 
   O    2.147732361   -3.235937867    4.566970911 
   N   -0.827034935    1.941056575    5.456276986 
   O   -0.664980651    1.937827910    6.682807272 
   O   -1.344712449    2.862494631    4.811013895 
   H    3.542916721    1.210848375   -1.690472331 
   H    3.516267023    0.255187255   -3.950701714 
   H    2.338011124   -0.785812440   -5.800042608 
   H    0.280858834   -1.675874131   -6.808401717 
   H   -1.842933270   -1.640605141   -5.528900184 
   H   -1.913324968   -0.734132090   -3.275123349 
   H   -1.624597528   -0.502496564   -1.146243762 
   H   -0.543322675    1.381183071    0.819968245 
   H   -1.299544913    2.562580221   -1.475210917 
   H   -3.706273018    2.568127947   -1.694549017 
   H   -3.778042218    0.754660711   -1.300017753 
   H    0.838193823   -2.330137088    2.692057299 
   H    0.670142618   -0.100965914    6.403154288 
   H   -1.335910032    1.386466958    2.870890970 
   H    1.503619500    1.287000659   -0.345795289 
