C,1,20.95,s,
C,2,38.9,s,
C,3,30.7,s,
C,4,36.8,s,
C,5,48.4,s,
C,6,180.3,s,
O,7,,,
O,8,,,
C,9,23.9,s,
C,10,28.2,s,
C,11,42.6,s,
C,12,22.69,s,
C,13,139.0,s,
C,14,125.8,s,
C,15,23.4,s,
C,16,47.45,s,
C,17,38.35,s,
C,18,17.05,s,
C,19,48.4,s,
C,20,67.75,s,
O,21,,,
C,22,76.9,s,
O,23,,,
C,24,167.33,s,
O,25,,,
C,26,117.99,s,
C,27,143.9,s,
C,28,126.6,s,
C,29,131.21,s,
C,30,116.13,s,
C,31,159.17,s,
O,32,,,
C,33,116.13,s,
C,34,131.21,s,
C,35,38.35,s,
C,36,23.4,s,
C,37,23.4,s,
C,38,54.35,s,
C,39,18.17,s,
C,40,32.72,s,
C,41,39.9,s,
C,42,16.6,s,
C,43,53.1,s,
C,44,39.2,s,
C,45,16.9,s,
H,46,0.95,d,6.5
H,47,0.95,d,6.5
H,48,0.95,d,6.5
H,49,0.95,m,
H,50,1.61,m,
H,51,1.61,m,
H,52,1.72,ddd,"12.4,10.9,6.4"
H,53,1.72,ddd,"12.4,10.9,1.7"
H,54,,,
H,55,2.31,ddd,"12.4,5.6,2.5"
H,56,2.31,ddd,"12.4,12.3,5.8"
H,57,1.65,ddd,"12.4,5.8,2.5"
H,58,1.65,ddd,"12.4,12.3,5.6"
H,59,1.31,s,
H,60,1.31,s,
H,61,1.31,s,
H,62,5.48,dd,"5.6,2.6"
H,63,2.03,ddd,"15.4,5.6,2.4"
H,64,2.03,ddd,"15.4,12.8,2.6"
H,65,1.63,dd,"12.8,2.4"
H,66,1.49,s,
H,67,1.49,s,
H,68,1.49,s,
H,69,2.21,dd,"12.4,12.1"
H,70,2.21,dd,"12.4,1.4"
H,71,4.71,ddd,"12.1,9.9,1.4"
H,72,,,
H,73,5.08,d,9.9
H,74,6.4,d,12.0
H,75,7.57,d,12.0
H,76,7.39,ddd,"9.6,1.9,0.5"
H,77,6.79,ddd,"9.6,1.9,0.5"
H,78,,,
H,79,6.79,ddd,"7.1,1.9,0.5"
H,80,7.39,ddd,"7.1,1.9,0.5"
H,81,1.14,s,
H,82,1.14,s,
H,83,1.14,s,
H,84,1.14,s,
H,85,1.14,s,
H,86,1.14,s,
H,87,1.07,dd,"9.8,8.6"
H,88,1.46,dtd,"12.4,9.8,1.5"
H,89,1.46,m,
H,90,1.49,ddd,"12.4,9.8,8.1"
H,91,1.49,ddd,"12.4,10.2,1.5"
H,92,1.08,s,
H,93,1.08,s,
H,94,1.08,s,
H,95,2.79,d,11.1
H,96,1.39,ddq,"11.1,8.1,6.6"
H,97,0.8,d,6.6
H,98,0.8,d,6.6
H,99,0.8,d,6.6
