 46 
 
   C   -1.330042100    1.436916800   -0.834033200 
   C   -2.276420600    1.160498000   -1.807111800 
   C   -1.944236400    1.345894000   -3.171025500 
   C   -0.704098300    1.767402900   -3.556034700 
   C    0.285289800    2.061578400   -2.592068300 
   C   -0.035290100    1.920723400   -1.206522100 
   C    1.578629600    2.491132300   -2.977648200 
   C    2.536158700    2.783466900   -2.044039700 
   C    2.221025700    2.682677000   -0.674327100 
   C    0.975823900    2.273102800   -0.270886400 
   C   -3.654231000    0.641396600   -1.475272400 
   C   -1.654658300    1.134776000    0.624712400 
   N   -0.731751400    0.131267300    1.174983200 
   C   -1.772676100    2.316236600    1.555699200 
   C   -1.841177700    3.588392400    1.189486200 
   C   -0.950921700   -1.195068100    0.999397200 
   C    0.199952200   -2.108159900    1.338602500 
   O   -2.006339100   -1.659437700    0.598625500 
   C   -0.106415000   -3.421857800    1.690612000 
   C    0.922401100   -4.305429100    1.966635300 
   C    2.257407400   -3.941372300    1.887350400 
   C    2.532383800   -2.636578100    1.520478300 
   C    1.531907100   -1.715258300    1.244946800 
   N    0.592267600   -5.699912300    2.353629800 
   O    1.524346500   -6.451567400    2.584230200 
   O   -0.586747900   -5.999950500    2.414922400 
   N    3.947101600   -2.209218900    1.409447000 
   O    4.158617800   -1.041575500    1.124059500 
   O    4.805402300   -3.049348000    1.613160800 
   H   -2.693410200    1.126896500   -3.920882100 
   H   -0.464279900    1.880317700   -4.606076100 
   H    1.797364800    2.583293000   -4.034427000 
   H    3.523068700    3.103165100   -2.350271200 
   H    2.964939500    2.943356400    0.066825000 
   H    0.755060600    2.277626400    0.785717200 
   H   -3.597905900   -0.321869000   -0.964486600 
   H   -4.200120200    1.330996500   -0.828109600 
   H   -4.242235000    0.506883500   -2.381600400 
   H   -2.618700900    0.632321800    0.655654400 
   H    0.180543200    0.438581500    1.460347300 
   H   -1.865968200    2.046351500    2.603546800 
   H   -1.988147400    4.373054300    1.919187000 
   H   -1.752155700    3.886935600    0.153022500 
   H   -1.136617400   -3.740357300    1.733885700 
   H    3.046072800   -4.645528100    2.095641300 
   H    1.818782000   -0.722752500    0.930016100 
