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,8,38.35,s,
C,9,17.05,s,
C,10,48.4,s,
C,11,67.75,s,
O,12,,,
C,13,76.9,s,
O,14,,,
C,15,167.33,s,
O,16,,,
C,17,114.65,s,
C,18,147.18,s,
C,19,127.21,s,
C,20,122.65,s,
C,21,116.43,s,
C,22,148.58,s,
O,23,,,
C,24,146.82,s,
O,25,,,
C,26,115.15,s,
C,27,38.35,s,
C,28,23.4,s,
C,29,23.4,s,
C,30,54.35,s,
C,31,18.17,s,
C,32,32.72,s,
C,33,39.9,s,
C,34,16.6,s,
C,35,42.6,s,
C,36,22.69,s,
C,37,28.2,s,
C,38,23.9,s,
C,39,48.4,s,
C,40,180.3,s,
O,41,,,
O,42,,,
C,43,36.8,s,
C,44,30.7,s,
C,45,38.9,s,
C,46,20.95,s,
H,47,0.8,d,6.6
H,48,0.8,d,6.6
H,49,0.8,d,6.6
H,50,1.39,dqd,"6.9,6.6,2.9"
H,51,2.79,d,2.9
H,52,5.48,dd,"4.0,3.4"
H,53,2.03,ddd,"15.4,12.4,3.4"
H,54,2.03,ddd,"15.4,5.9,4.0"
H,55,1.63,dd,"12.4,5.9"
H,56,1.49,s,
H,57,1.49,s,
H,58,1.49,s,
H,59,2.21,dd,"12.4,6.6"
H,60,2.21,dd,"12.4,9.7"
H,61,4.71,ddd,"9.7,6.6,5.3"
H,62,,,
H,63,5.08,d,5.3
H,64,6.33,d,12.0
H,65,7.61,d,12.0
H,66,6.96,dd,"8.4,1.9"
H,67,6.8,dd,"8.4,0.5"
H,68,,,
H,69,,,
H,70,7.03,dd,"1.9,0.5"
H,71,1.14,s,
H,72,1.14,s,
H,73,1.14,s,
H,74,1.14,s,
H,75,1.14,s,
H,76,1.14,s,
H,77,1.07,dd,"12.9,5.0"
H,78,1.46,m,
H,79,1.46,m,
H,80,1.49,ddd,"12.4,11.5,2.0"
H,81,1.49,ddd,"12.4,11.8,4.5"
H,82,1.08,s,
H,83,1.08,s,
H,84,1.08,s,
H,85,1.31,s,
H,86,1.31,s,
H,87,1.31,s,
H,88,1.65,ddd,"12.4,9.8,9.2"
H,89,1.65,ddd,"12.4,7.6,1.5"
H,90,2.31,ddd,"12.4,9.2,7.6"
H,91,2.31,ddd,"12.4,9.8,1.5"
H,92,,,
H,93,1.72,ddd,"12.4,10.6,8.6"
H,94,1.72,ddd,"12.4,9.0,0.8"
H,95,1.61,m,
H,96,1.61,m,
H,97,0.95,m,
H,98,0.95,d,6.5
H,99,0.95,d,6.5
H,100,0.95,d,6.5
