C,1,19.5,s,
C,2,64.9,s,
O,3,,,
C,4,171.99,s,
O,5,,,
C,6,162.67,s,
O,7,,,
C,8,111.7,s,
C,9,155.52,s,
C,10,140.77,s,
C,11,32.48,s,
C,12,77.06,s,
O,13,,,
C,14,182.52,s,
O,15,,,
C,16,42.73,s,
C,17,24.26,s,
C,18,30.0,s,
C,19,27.42,s,
C,20,75.84,s,
O,21,,,
C,22,42.53,s,
C,23,16.94,s,
C,24,53.43,s,
H,25,1.31,d,6.3
H,26,1.31,d,6.3
H,27,1.31,d,6.3
H,28,4.52,q,6.3
H,29,,,
H,30,5.96,s,
H,31,2.56,dd,"15.4,0.8"
H,32,2.56,dd,"15.4,7.2"
H,33,4.88,ddd,"7.2,3.5,0.8"
H,34,1.3,s,
H,35,1.3,s,
H,36,1.3,s,
H,37,1.72,ddd,"12.4,11.7,2.0"
H,38,1.72,ddd,"12.4,11.8,4.2"
H,39,1.79,m,
H,40,1.79,m,
H,41,4.12,dd,"9.0,7.9"
H,42,,,
H,43,1.19,s,
H,44,1.19,s,
H,45,1.19,s,
H,46,2.38,d,3.5
