C,1,29.13,s,
C,2,64.65,s,
C,3,29.13,s,
S,4,,,
C,5,66.95,s,
C,6,58.4,s,
N,7,,,
C,8,167.6,s,
O,9,,,
C,10,65.6,s,
O,11,,,
C,12,158.0,s,
C,13,115.1,s,
C,14,130.01,s,
C,15,121.18,s,
C,16,130.01,s,
C,17,115.1,s,
C,18,171.5,s,
O,19,,,
N,20,,,
C,21,73.25,s,
C,22,172.0,s,
O,23,,,
O,24,,,
H,25,1.5,s,
H,26,1.5,s,
H,27,1.5,s,
H,28,1.5,s,
H,29,1.5,s,
H,30,1.5,s,
H,31,5.51,d,8.8
H,32,5.64,dd,"8.8,7.0"
H,33,7.4,d,7.0
H,34,4.23,s,
H,35,4.23,s,
H,36,6.88,m,
H,37,7.28,m,
H,38,7.04,ddt,"8.5,7.1,1.4"
H,39,7.28,m,
H,40,6.88,m,
H,41,4.61,s,
H,42,,,
