 46 
 
   C   -1.326627600    1.384305900   -1.127063500 
   C   -2.407763800    1.237601800   -1.981159400 
   C   -2.252973000    1.533702000   -3.356762700 
   C   -1.057473600    1.948162000   -3.870782900 
   C    0.061758700    2.127646700   -3.028913800 
   C   -0.075496700    1.867984000   -1.629630500 
   C    1.304359900    2.569398500   -3.545005200 
   C    2.382413200    2.766246300   -2.724206300 
   C    2.248694100    2.547602900   -1.338593800 
   C    1.058426900    2.119256300   -0.807372500 
   C   -3.762671600    0.771665000   -1.504562600 
   C   -1.477952300    1.002111700    0.335038900 
   N   -0.492071200   -0.031065600    0.700524200 
   C   -1.466224100    2.145692500    1.328129700 
   C   -1.530668400    3.434753300    1.029051100 
   C   -0.780156500   -1.003216800    1.595207400 
   C    0.308948600   -2.018003500    1.850709800 
   O   -1.849174000   -1.082014100    2.181187600 
   C    1.655067800   -1.779994100    1.588357800 
   C    2.589493500   -2.763290200    1.879602000 
   C    2.234694800   -3.984477800    2.423674600 
   C    0.888956000   -4.190947300    2.681847300 
   C   -0.074464400   -3.233062000    2.416846600 
   N    4.020610800   -2.492610300    1.605802600 
   O    4.816776200   -3.382741700    1.846252400 
   O    4.307011300   -1.394637500    1.155821300 
   N    0.474429200   -5.488724200    3.271177200 
   O   -0.711399500   -5.645678500    3.502342000 
   O    1.349486700   -6.310782900    3.483810300 
   H   -3.106031000    1.414405700   -4.012033000 
   H   -0.956300700    2.151141400   -4.929648700 
   H    1.384899700    2.752499500   -4.609377300 
   H    3.327534500    3.100675000   -3.130500900 
   H    3.089956300    2.732447500   -0.683887400 
   H    0.979236200    2.015140700    0.263809400 
   H   -3.728002900   -0.246758700   -1.112232100 
   H   -4.151782900    1.412187600   -0.710929200 
   H   -4.481825600    0.783699400   -2.321978700 
   H   -2.438579300    0.510635600    0.474749700 
   H    0.354232500   -0.079109200    0.162346700 
   H   -1.460916800    1.821525600    2.363679300 
   H   -1.568984100    4.187375600    1.805109800 
   H   -1.545213500    3.782834900    0.004224900 
   H    2.006937800   -0.842594600    1.184971600 
   H    2.972379900   -4.738859100    2.642734000 
   H   -1.113549900   -3.412127500    2.647631900 
