 40 
 
   C   -0.027941878   -0.082546775   -1.452330419 
   C    0.394482777   -1.421270454   -1.489236654 
   C   -0.452424613   -2.448280395   -1.065998903 
   C   -1.740737899   -2.160856007   -0.603806572 
   C   -2.185577259   -0.835033431   -0.611821897 
   C   -1.339218826    0.193625243   -1.032634829 
   C   -2.656008519   -3.268488841   -0.171568960 
   C    0.896712307    1.058554938   -1.841403947 
   N    2.244528840    0.917342944   -1.305493473 
   C    1.027255791    1.183189984   -3.336837839 
   C    0.832915258    2.315335070   -4.028649795 
   C    2.644063656    0.893057241    0.004809568 
   O    3.827284414    0.912596829    0.320388782 
   C    1.629206583    0.794710857    1.065498494 
   C    1.416990538   -0.447883268    1.670854381 
   C    0.399533355   -0.574957724    2.622678209 
   C   -0.372624589    0.533243384    3.000740366 
   C   -0.113537278    1.775397552    2.402688940 
   C    0.889083936    1.918888015    1.435711439 
   N   -0.925300109    2.939294665    2.771727482 
   O   -1.606982741    2.859383964    3.801390443 
   O   -0.883872569    3.923852140    2.021610656 
   N    0.117334269   -1.892014620    3.207099655 
   O   -0.856518047   -1.983414126    3.966759358 
   O    0.866989395   -2.830031527    2.905008112 
   H    1.397420858   -1.671973400   -1.830359798 
   H   -0.096814453   -3.476625172   -1.095219458 
   H   -3.198021270   -0.595584149   -0.292326959 
   H   -1.712264547    1.216143160   -1.026193866 
   H   -2.087691178   -4.093231103    0.271246560 
   H   -3.362020021   -2.917015420    0.588206034 
   H   -3.218749333   -3.646109261   -1.030705620 
   H    0.503206024    1.994398058   -1.425123246 
   H    3.016106533    1.053638401   -1.947046018 
   H    1.283586042    0.278728605   -3.886012865 
   H    0.935534307    2.328253420   -5.110088191 
   H    0.568903523    3.249336421   -3.541837479 
   H    2.018492101   -1.302117146    1.363469242 
   H   -1.166691010    0.429672877    3.739474738 
   H    1.093365633    2.878789050    0.965334330 
