C,1,58.8,s,
O,2,,,
C,3,186.37,s,
S,4,,,
N,5,,,
C,6,48.42,s,
C,7,139.21,s,
C,8,129.0,s,
C,9,114.5,s,
C,10,157.92,s,
O,11,,,
C,12,99.8,s,
O,13,,,
C,14,71.15,s,
C,15,17.35,s,
C,16,73.6,s,
O,17,,,
C,18,72.1,s,
O,19,,,
C,20,71.8,s,
O,21,,,
C,22,114.5,s,
C,23,129.0,s,
H,24,3.69,s,
H,25,3.69,s,
H,26,3.69,s,
H,27,,,
H,28,4.24,s,
H,29,4.24,s,
H,30,7.24,ddd,"7.3,1.9,0.5"
H,31,6.98,ddd,"7.3,1.9,0.5"
H,32,5.52,d,9.1
H,33,3.72,qd,"6.1,4.5"
H,34,1.27,d,6.1
H,35,1.27,d,6.1
H,36,1.27,d,6.1
H,37,3.51,dd,"8.3,4.5"
H,38,,,
H,39,3.86,dd,"8.3,7.6"
H,40,,,
H,41,4.0,dd,"9.1,7.6"
H,42,,,
H,43,6.98,ddd,"8.9,1.9,0.5"
H,44,7.24,ddd,"8.9,1.9,0.5"
