C,1,12.4,s,
C,2,40.5,s,
C,3,178.2,s,
O,4,,,
O,5,,,
C,6,79.5,s,
C,7,52.3,s,
C,8,23.04,s,
C,9,35.62,s,
C,10,41.4,s,
C,11,20.67,s,
C,12,73.58,s,
O,13,,,
C,14,133.23,s,
C,15,135.73,s,
C,16,70.0,s,
C,17,23.7,s,
O,18,,,
C,19,47.92,s,
H,20,1.33,d,6.7
H,21,1.33,d,6.7
H,22,1.33,d,6.7
H,23,2.42,dq,"9.3,6.7"
H,24,5.03,dd,"10.8,10.6"
H,25,2.02,m,
H,26,1.85,m,
H,27,1.85,m,
H,28,1.67,ddd,"14.1,12.4,4.1"
H,29,1.67,ddd,"12.4,4.3,3.2"
H,30,0.87,s,
H,31,0.87,s,
H,32,0.87,s,
H,33,4.37,d,2.8
H,34,,,
H,35,5.8,dd,"11.0,2.8"
H,36,5.99,d,11.0
H,37,1.53,s,
H,38,1.53,s,
H,39,1.53,s,
H,40,,,
H,41,3.07,d,10.8
