 40 
 
   C   -2.278767500   -0.413213200   -0.849536800 
   C   -2.985494100   -0.471248500    0.361776800 
   C   -3.682438500   -1.622594500    0.726355100 
   C   -3.694190100   -2.758095100   -0.102958500 
   C   -2.986805400   -2.693925600   -1.311912100 
   C   -2.288129600   -1.539944500   -1.681764200 
   C   -4.431000600   -4.007595800    0.313111000 
   C   -1.469692700    0.831752700   -1.198937700 
   N   -0.141336300    0.733845200   -0.597797800 
   C   -1.428845100    1.113423100   -2.685693200 
   C   -0.331670400    1.302092300   -3.421145300 
   C    0.428812400    1.759089400    0.094519700 
   O   -0.102741400    2.845826100    0.253205200 
   C    1.800782600    1.488726300    0.674822300 
   C    2.595553900    2.607530400    0.964358300 
   C    3.857803100    2.422006800    1.520548100 
   C    4.363113500    1.159650500    1.826407900 
   C    3.546457200    0.068549800    1.546894900 
   C    2.278882500    0.208385600    0.978597800 
   N    4.039724000   -1.293654000    1.871584800 
   O    5.147140900   -1.382919900    2.370038600 
   O    3.301937600   -2.230188800    1.613683600 
   N    4.702004600    3.611361700    1.806607700 
   O    5.792507200    3.410405000    2.312339200 
   O    4.245857400    4.701772900    1.513953800 
   H   -2.989439100    0.399687300    1.024153200 
   H   -4.233265000   -1.642066100    1.671652000 
   H   -2.985649900   -3.560148200   -1.980227200 
   H   -1.752285300   -1.513865000   -2.634666000 
   H   -5.413948500   -3.768251400    0.750051100 
   H   -4.591158200   -4.688712400   -0.536419000 
   H   -3.862491700   -4.561915100    1.080402500 
   H   -1.940778100    1.702680400   -0.714308500 
   H    0.378806000   -0.117497700   -0.772170500 
   H   -2.417630600    1.165701700   -3.156089100 
   H   -0.396217600    1.517805700   -4.490853700 
   H    0.668618600    1.263970100   -2.979528800 
   H    2.218374400    3.609276500    0.758427000 
   H    5.349825800    1.034732000    2.268875200 
   H    1.687773700   -0.692435400    0.811642700 
