 40 
 
   C   -2.329200900   -0.173277500   -0.406504800 
   C   -2.130822600   -1.430877200   -0.980011700 
   C   -2.952375000   -2.499647700   -0.651466800 
   C   -4.005490100   -2.347521200    0.252339500 
   C   -4.200327000   -1.089505800    0.820941900 
   C   -3.374882800   -0.018831600    0.498423400 
   C   -4.917737300   -3.500238000    0.576634700 
   C   -1.428223000    0.992953500   -0.753569600 
   N   -0.042814600    0.662893500   -0.376731000 
   C   -1.504311600    1.360209400   -2.216936400 
   C   -1.768728100    2.581655400   -2.656687600 
   C    0.854085800    1.626504500   -0.051379900 
   O    0.591692800    2.817257600   -0.059176700 
   C    2.232322700    1.148015600    0.338699100 
   C    2.757927400   -0.077515100   -0.059117000 
   C    4.045273800   -0.423833500    0.326783000 
   C    4.835684300    0.406701600    1.100385500 
   C    4.288304900    1.622712900    1.477805800 
   C    3.013077000    2.011822100    1.105488300 
   N    5.107610200    2.538085600    2.310856000 
   O    6.237664800    2.177042800    2.592661300 
   O    4.595626200    3.587433300    2.658711000 
   N    4.595005700   -1.728977100   -0.109289900 
   O    5.729731500   -2.005460100    0.237225400 
   O    3.872589100   -2.443634900   -0.785814300 
   H   -1.330026000   -1.581235500   -1.694829300 
   H   -2.775929200   -3.466592700   -1.106762800 
   H   -5.005401600   -0.944397800    1.530996700 
   H   -3.545033100    0.946673300    0.958278100 
   H   -4.378865800   -4.448280600    0.572427200 
   H   -5.383728600   -3.377485200    1.554336800 
   H   -5.720016100   -3.578866500   -0.161618300 
   H   -1.716505200    1.863401900   -0.163908000 
   H    0.163912600   -0.301021400   -0.179557100 
   H   -1.320604400    0.551145600   -2.916939800 
   H   -1.816710200    2.803811400   -3.714597500 
   H   -1.933078500    3.404074000   -1.971641000 
   H    2.205981400   -0.762693900   -0.683975200 
   H    5.833388700    0.122949500    1.392399000 
   H    2.620931900    2.974549500    1.395118100 
