C,1,90.6,s,
C,2,157.83,s,
O,3,,,
C,4,77.06,s,
C,5,42.83,s,
C,6,34.96,s,
C,7,21.51,s,
C,8,34.97,s,
C,9,22.33,s,
C,10,33.67,s,
C,11,150.99,s,
C,12,109.66,s,
C,13,77.48,s,
O,14,,,
O,15,,,
C,16,37.71,s,
C,17,44.98,s,
C,18,132.07,s,
C,19,114.59,s,
H,20,4.22,s,
H,21,4.22,s,
H,22,4.88,ddd,"7.4,6.3,2.3"
H,23,2.1,dd,"12.4,2.3"
H,24,2.1,dd,"12.4,6.3"
H,25,1.13,s,
H,26,1.13,s,
H,27,1.13,s,
H,28,1.72,ddd,"12.4,12.1,7.2"
H,29,1.72,ddd,"12.4,5.1,1.6"
H,30,1.55,m,
H,31,1.55,m,
H,32,2.22,ddd,"15.4,13.2,5.4"
H,33,2.22,ddd,"15.4,5.8,2.8"
H,34,5.18,s,
H,35,5.18,s,
H,36,,,
H,37,1.96,dd,"12.4,1.0"
H,38,1.96,dd,"12.4,9.0"
H,39,3.09,ddd,"9.0,7.4,1.0"
H,40,5.27,s,
H,41,5.27,s,
