C,1,20.02,s,
C,2,30.74,s,
C,3,35.5,s,
C,4,26.3,s,
C,5,41.3,s,
C,6,43.1,s,
C,7,16.0,s,
C,8,182.1,s,
O,9,,,
O,10,,,
C,11,38.52,s,
C,12,44.46,s,
C,13,28.16,s,
C,14,29.66,s,
C,15,57.8,s,
C,16,23.7,s,
O,17,,,
C,18,63.63,s,
H,19,0.88,d,6.5
H,20,0.88,d,6.5
H,21,0.88,d,6.5
H,22,1.64,m,
H,23,1.87,m,
H,24,1.87,m,
H,25,1.26,m,
H,26,1.26,m,
H,27,1.74,m,
H,28,2.63,qd,"6.7,5.7"
H,29,0.92,d,6.7
H,30,0.92,d,6.7
H,31,0.92,d,6.7
H,32,,,
H,33,2.4,ddd,"7.5,5.5,3.3"
H,34,1.88,m,
H,35,1.58,m,
H,36,1.58,m,
H,37,1.5,ddd,"13.5,12.4,2.8"
H,38,1.5,ddd,"12.4,5.1,3.6"
H,39,1.38,s,
H,40,1.38,s,
H,41,1.38,s,
H,42,2.88,d,7.5
