C,1,12.99,s,
C,2,41.44,s,
C,3,178.59,s,
O,4,,,
O,5,,,
C,6,81.34,s,
C,7,45.42,s,
C,8,29.8,s,
C,9,35.16,s,
C,10,18.52,s,
C,11,51.6,s,
C,12,71.11,s,
O,13,,,
C,14,27.33,s,
C,15,37.5,s,
C,16,74.62,s,
C,17,25.92,s,
O,18,,,
C,19,48.16,s,
H,20,1.27,d,6.7
H,21,1.27,d,6.7
H,22,1.27,d,6.7
H,23,2.53,dq,"9.9,6.7"
H,24,4.6,dd,"11.0,9.8"
H,25,2.29,m,
H,26,1.79,ddd,"12.4,12.3,12.1"
H,27,1.79,ddd,"12.4,4.3,4.2"
H,28,1.68,m,
H,29,0.92,d,6.5
H,30,0.92,d,6.5
H,31,0.92,d,6.5
H,32,2.17,ddd,"11.4,10.8,8.2"
H,33,4.19,ddd,"11.4,8.2,3.2"
H,34,,,
H,35,2.04,m,
H,36,2.04,m,
H,37,1.9,ddd,"12.4,4.5,1.9"
H,38,1.9,ddd,"13.6,12.4,3.3"
H,39,1.31,s,
H,40,1.31,s,
H,41,1.31,s,
H,42,,,
H,43,2.52,dd,"11.4,9.8"
