C,1,22.29,s,
C,2,170.62,s,
O,3,,,
O,4,,,
C,5,67.86,s,
C,6,28.55,s,
C,7,35.28,s,
C,8,39.6,s,
C,9,39.63,s,
C,10,75.9,s,
O,11,,,
N,12,,,
C,13,53.95,s,
C,14,126.93,s,
C,15,106.03,s,
C,16,147.4,s,
C,17,146.95,s,
C,18,108.48,s,
C,19,146.19,s,
O,20,,,
C,21,101.55,s,
O,22,,,
C,23,64.27,s,
C,24,36.08,s,
H,25,2.03,s,
H,26,2.03,s,
H,27,2.03,s,
H,28,4.7,m,
H,29,1.7,m,
H,30,1.7,m,
H,31,1.72,ddd,"12.4,8.7,1.2"
H,32,1.72,ddd,"12.4,10.5,9.1"
H,33,2.05,dd,"12.4,8.4"
H,34,2.05,dd,"12.4,7.5"
H,35,5.68,dd,"8.4,7.5"
H,36,,,
H,37,4.25,s,
H,38,4.25,s,
H,39,6.52,d,0.5
H,40,6.57,d,0.5
H,41,5.88,s,
H,42,5.88,s,
H,43,3.78,dd,"9.7,1.2"
H,44,2.2,ddd,"12.4,11.6,9.7"
H,45,2.2,ddd,"12.4,7.2,1.2"
