C,1,55.67,s,
O,2,,,
C,3,151.4,s,
C,4,110.77,s,
C,5,127.53,s,
C,6,125.36,s,
C,7,126.3,s,
C,8,144.6,s,
O,9,,,
C,10,59.75,s,
C,11,131.6,s,
C,12,127.3,s,
C,13,126.4,s,
C,14,126.7,s,
C,15,127.7,s,
C,16,135.9,s,
C,17,36.04,s,
C,18,60.72,s,
N,19,,,
C,20,161.74,s,
O,21,,,
C,22,49.76,s,
C,23,28.2,s,
H,24,3.81,s,
H,25,3.81,s,
H,26,3.81,s,
H,27,6.73,s,
H,28,3.78,s,
H,29,3.78,s,
H,30,3.78,s,
H,31,7.67,ddd,"10.6,1.4,0.5"
H,32,7.39,ddd,"10.6,6.5,1.4"
H,33,7.3,ddd,"7.6,6.5,1.4"
H,34,7.3,ddd,"7.6,1.4,0.5"
H,35,2.9,dd,"15.4,8.0"
H,36,2.9,dd,"15.4,10.2"
H,37,4.48,dd,"10.2,8.0"
H,38,8.38,s,
H,39,4.4,ddd,"12.4,4.5,1.5"
H,40,4.4,ddd,"12.9,12.4,1.6"
H,41,2.85,ddd,"15.4,4.5,1.6"
H,42,2.85,ddd,"15.4,12.9,1.5"
