 40 
 
   C   -2.067531800   -0.181278100   -1.251278500 
   C   -2.036484600   -1.305810700   -2.087692700 
   C   -2.757563900   -2.456740100   -1.759710600 
   C   -3.531087900   -2.520831400   -0.589867300 
   C   -3.554492200   -1.391113000    0.244500100 
   C   -2.834721700   -0.239374900   -0.078482300 
   C   -4.331681200   -3.756302300   -0.257556900 
   C   -1.217941200    1.056268600   -1.532357900 
   N    0.059734100    0.952517100   -0.828754000 
   C   -1.041119300    1.346702900   -3.004189900 
   C    0.104014500    1.650732400   -3.619867300 
   C    0.303792700    1.607929700    0.338522100 
   O   -0.451024100    2.440420200    0.817429300 
   C    1.604824700    1.271028100    1.035512600 
   C    2.102122400    2.219761200    1.941254000 
   C    3.280991400    1.952800000    2.631345200 
   C    3.985042800    0.759876600    2.477331800 
   C    3.459379500   -0.171750000    1.587974200 
   C    2.287375000    0.060591800    0.866360000 
   N    4.167528200   -1.463819000    1.405711100 
   O    5.177804100   -1.645169600    2.060380000 
   O    3.688028700   -2.254436100    0.609757000 
   N    3.811025000    2.970490800    3.576416200 
   O    4.834911800    2.691802400    4.175794600 
   O    3.186464300    4.010182700    3.684466200 
   H   -1.441561700   -1.283649500   -3.005240100 
   H   -2.717549600   -3.324202900   -2.425840500 
   H   -4.145885800   -1.414431000    1.164717800 
   H   -2.854657300    0.625175200    0.591599500 
   H   -3.786594100   -4.675070000   -0.526781500 
   H   -4.576830500   -3.804993600    0.814453500 
   H   -5.284809100   -3.769840600   -0.815030700 
   H   -1.723882100    1.922574500   -1.075603600 
   H    0.704606900    0.244648000   -1.159193100 
   H   -1.972795300    1.306676100   -3.579693200 
   H    0.129100700    1.866794400   -4.691170600 
   H    1.052136800    1.716939800   -3.077770800 
   H    1.559383600    3.151341300    2.102397600 
   H    4.901032500    0.564660100    3.032284100 
   H    1.928913800   -0.731101100    0.207874600 
