C,1,12.5,s,
C,2,35.0,s,
C,3,171.76,s,
O,4,,,
O,5,,,
C,6,99.28,s,
O,7,,,
C,8,105.73,s,
C,9,24.38,s,
C,10,33.56,s,
C,11,28.16,s,
C,12,46.95,s,
C,13,32.43,s,
C,14,19.61,s,
C,15,33.9,s,
C,16,24.3,s,
C,17,46.7,s,
C,18,77.48,s,
O,19,,,
H,20,1.21,d,6.7
H,21,1.21,d,6.7
H,22,1.21,d,6.7
H,23,3.39,qd,"6.7,5.7"
H,24,5.59,s,
H,25,1.38,s,
H,26,1.38,s,
H,27,1.38,s,
H,28,2.02,ddd,"12.4,3.7,2.7"
H,29,2.02,ddd,"13.8,12.4,3.8"
H,30,1.58,m,
H,31,1.58,m,
H,32,2.13,ddd,"12.7,7.6,7.2"
H,33,1.42,m,
H,34,1.0,d,6.5
H,35,1.0,d,6.5
H,36,1.0,d,6.5
H,37,1.42,m,
H,38,1.42,m,
H,39,1.48,m,
H,40,1.48,m,
H,41,2.13,ddd,"11.9,5.7,2.7"
