C,1,15.05,s,
C,2,42.36,s,
C,3,75.7,s,
O,4,,,
C,5,35.12,s,
C,6,40.93,s,
C,7,63.73,s,
O,8,,,
C,9,134.87,s,
C,10,59.85,s,
O,11,,,
C,12,141.77,s,
C,13,42.24,s,
C,14,42.2,s,
C,15,24.55,s,
C,16,71.0,s,
O,17,,,
C,18,42.11,s,
C,19,42.38,s,
H,20,0.99,d,6.6
H,21,0.99,d,6.6
H,22,0.99,d,6.6
H,23,2.01,ddq,"11.3,8.9,6.6"
H,24,3.8,ddd,"10.7,8.9,1.2"
H,25,,,
H,26,1.88,ddd,"12.4,1.6,1.2"
H,27,1.88,ddd,"12.4,10.7,5.6"
H,28,3.17,tdd,"6.0,5.6,1.6"
H,29,3.66,d,6.0
H,30,3.66,d,6.0
H,31,,,
H,32,4.17,s,
H,33,4.17,s,
H,34,,,
H,35,2.43,s,
H,36,2.43,s,
H,37,1.13,s,
H,38,1.13,s,
H,39,1.13,s,
H,40,3.97,s,
H,41,3.97,s,
H,42,,,
H,43,2.04,dd,"12.4,5.0"
H,44,2.04,dd,"13.2,12.4"
H,45,2.99,ddd,"13.2,11.3,5.0"
