C,1,20.96,s,
C,2,26.93,s,
C,3,20.96,s,
C,4,141.77,s,
C,5,147.7,s,
C,6,40.4,s,
C,7,28.16,s,
C,8,34.9,s,
C,9,77.48,s,
C,10,25.81,s,
O,11,,,
C,12,75.0,s,
O,13,,,
C,14,61.74,s,
C,15,26.69,s,
N,16,,,
C,17,132.91,s,
S,18,,,
C,19,34.93,s,
C,20,31.9,s,
H,21,0.89,d,6.7
H,22,0.89,d,6.7
H,23,0.89,d,6.7
H,24,2.57,m,6.7
H,25,0.89,d,6.7
H,26,0.89,d,6.7
H,27,0.89,d,6.7
H,28,2.83,dd,"10.7,7.2"
H,29,1.58,m,
H,30,1.58,m,
H,31,1.9,ddd,"12.4,8.6,1.1"
H,32,1.9,ddd,"12.4,12.2,6.0"
H,33,1.4,s,
H,34,1.4,s,
H,35,1.4,s,
H,36,,,
H,37,4.01,s,
H,38,,,
H,39,1.41,s,
H,40,1.41,s,
H,41,1.41,s,
H,42,1.99,ddd,"12.4,10.0,9.4"
H,43,1.99,ddd,"12.4,9.6,1.4"
H,44,2.37,ddd,"15.4,10.0,1.4"
H,45,2.37,ddd,"15.4,9.6,9.4"
