C,1,16.9,s,
C,2,39.2,s,
C,3,53.1,s,
C,4,139.0,s,
C,5,125.8,s,
C,6,23.4,s,
C,7,47.45,s,
C,8,37.9,s,
C,9,17.3,s,
C,10,42.83,s,
C,11,68.6,s,
O,12,,,
C,13,77.86,s,
O,14,,,
C,15,55.6,s,
C,16,10.3,s,
C,17,,,
O,18,,,
C,19,47.6,s,
C,20,20.5,s,
C,21,32.7,s,
C,22,39.9,s,
C,23,16.6,s,
C,24,42.6,s,
C,25,22.69,s,
C,26,28.2,s,
C,27,23.9,s,
C,28,48.4,s,
C,29,180.3,s,
O,30,,,
O,31,,,
C,32,36.8,s,
C,33,30.7,s,
C,34,38.9,s,
C,35,20.95,s,
H,36,0.8,d,6.6
H,37,0.8,d,6.6
H,38,0.8,d,6.6
H,39,1.39,qdd,"6.6,5.8,5.3"
H,40,2.79,d,5.8
H,41,5.48,t,3.7
H,42,2.03,ddd,"15.4,12.9,3.7"
H,43,2.03,ddd,"15.4,7.2,3.7"
H,44,1.63,dd,"12.9,7.2"
H,45,1.4,s,
H,46,1.4,s,
H,47,1.4,s,
H,48,2.19,dd,"12.4,1.3"
H,49,2.19,dd,"12.4,8.0"
H,50,4.3,ddd,"8.0,5.8,1.3"
H,51,,,
H,52,4.13,d,5.8
H,53,,,
H,54,1.13,s,
H,55,1.13,s,
H,56,1.13,s,
H,57,9.78,s,
H,58,2.11,dd,"12.8,4.1"
H,59,1.69,m,
H,60,1.69,m,
H,61,1.42,ddd,"12.4,3.4,3.1"
H,62,1.42,ddd,"13.4,12.4,3.7"
H,63,1.08,s,
H,64,1.08,s,
H,65,1.08,s,
H,66,1.31,s,
H,67,1.31,s,
H,68,1.31,s,
H,69,1.65,ddd,"12.4,11.0,7.2"
H,70,1.65,ddd,"12.4,8.7,2.1"
H,71,2.31,ddd,"12.4,7.2,2.1"
H,72,2.31,ddd,"12.4,11.0,8.7"
H,73,,,
H,74,1.72,ddd,"12.4,6.0,2.9"
H,75,1.72,ddd,"13.3,12.4,5.3"
H,76,1.61,m,
H,77,1.61,m,
H,78,0.95,m,
H,79,0.95,d,6.5
H,80,0.95,d,6.5
H,81,0.95,d,6.5
