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,11,41.92,s,
C,12,22.69,s,
C,13,139.0,s,
C,14,125.44,s,
C,15,22.99,s,
C,16,47.49,s,
C,17,36.6,s,
C,18,15.68,s,
C,19,37.5,s,
C,20,24.01,s,
C,21,80.3,s,
O,22,,,
C,23,167.5,s,
O,24,,,
C,25,115.0,s,
C,26,147.18,s,
C,27,127.21,s,
C,28,122.65,s,
C,29,116.43,s,
C,30,148.58,s,
O,31,,,
C,32,146.82,s,
O,33,,,
C,34,115.15,s,
C,35,38.45,s,
C,36,22.27,s,
C,37,22.27,s,
C,38,55.6,s,
C,39,18.6,s,
C,40,32.72,s,
C,41,39.19,s,
C,42,16.59,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,"12.4,9.6,7.7"
H,53,1.72,ddd,"12.4,11.4,1.2"
H,54,,,
H,55,2.31,ddd,"12.4,7.5,3.3"
H,56,2.31,ddd,"12.5,12.4,4.2"
H,57,1.65,ddd,"12.4,4.2,3.3"
H,58,1.65,ddd,"12.5,12.4,7.5"
H,59,1.31,s,
H,60,1.31,s,
H,61,1.31,s,
H,62,5.48,dd,"6.5,3.0"
H,63,1.93,ddd,"15.4,12.5,3.0"
H,64,1.93,ddd,"15.4,6.5,0.9"
H,65,1.82,dd,"12.5,0.9"
H,66,0.88,s,
H,67,0.88,s,
H,68,0.88,s,
H,69,1.97,ddd,"13.6,12.4,4.4"
H,70,1.97,ddd,"12.4,6.4,1.4"
H,71,1.84,m,
H,72,1.84,m,
H,73,4.56,dd,"11.9,5.2"
H,74,6.33,d,16.0
H,75,7.61,d,16.0
H,76,6.96,dd,"8.4,1.9"
H,77,6.8,dd,"8.4,0.5"
H,78,,,
H,79,,,
H,80,7.03,dd,"1.9,0.5"
H,81,0.88,s,
H,82,0.88,s,
H,83,0.88,s,
H,84,0.88,s,
H,85,0.88,s,
H,86,0.88,s,
H,87,1.22,dd,"11.0,6.2"
H,88,1.46,m,
H,89,1.46,m,
H,90,1.49,ddd,"12.4,10.7,8.5"
H,91,1.49,ddd,"12.4,8.9,1.6"
H,92,1.08,s,
H,93,1.08,s,
H,94,1.08,s,
H,95,2.79,d,4.4
H,96,1.39,qdd,"6.6,4.4,2.0"
H,97,0.8,d,6.6
H,98,0.8,d,6.6
H,99,0.8,d,6.6
