 40 
 
   C   -2.024471600   -0.054152700   -1.008071200 
   C   -3.256262000   -0.072163200   -0.362343200 
   C   -3.951457200   -1.263914000   -0.189345000 
   C   -3.434218700   -2.473211000   -0.650796800 
   C   -2.197844400   -2.449717500   -1.300639400 
   C   -1.505099200   -1.260953500   -1.476921000 
   C   -4.165458000   -3.769770100   -0.426934100 
   C   -1.268622100    1.248358100   -1.186581500 
   N    0.087549500    1.158771300   -0.630696300 
   C   -1.181039800    1.757952700   -2.605853500 
   C   -1.759000800    1.222330500   -3.672708800 
   C    0.389374900    1.572949500    0.625518000 
   O   -0.385309200    2.183206200    1.342448800 
   C    1.776046600    1.239960200    1.117399500 
   C    2.337014300    2.081727500    2.077010900 
   C    3.587929500    1.784762800    2.588857700 
   C    4.303240600    0.662371600    2.202151600 
   C    3.716734400   -0.162314700    1.259981800 
   C    2.471079700    0.106017100    0.710191100 
   N    4.440129600   -1.381212000    0.828339800 
   O    5.518737300   -1.608480100    1.346544900 
   O    3.907362700   -2.076675100   -0.021778700 
   N    4.189996000    2.692970400    3.596489800 
   O    5.270940600    2.373814100    4.061552100 
   O    3.564957400    3.696601600    3.889859600 
   H   -3.674282600    0.852101900    0.017260700 
   H   -4.908034800   -1.252070300    0.318838800 
   H   -1.774275800   -3.374195500   -1.674261400 
   H   -0.553877800   -1.275079600   -1.995255000 
   H   -5.242347900   -3.614500500   -0.359441900 
   H   -3.973392000   -4.479919500   -1.231646400 
   H   -3.844024000   -4.240488600    0.505963500 
   H   -1.762943200    2.013650300   -0.585483300 
   H    0.789463300    0.703221000   -1.187855400 
   H   -0.593929200    2.665652300   -2.709473300 
   H   -1.655978400    1.679314000   -4.647670500 
   H   -2.357083800    0.323092300   -3.608820000 
   H    1.790536800    2.946770100    2.420165400 
   H    5.270375400    0.439041100    2.621982700 
   H    2.057483700   -0.595818300    0.002019800 
