C,1,28.35,s,
C,2,30.0,s,
C,3,28.35,s,
C,4,34.5,s,
C,5,30.7,s,
C,6,44.5,s,
C,7,180.49,s,
O,8,,,
O,9,,,
C,10,39.8,s,
C,11,45.8,s,
C,12,142.5,s,
C,13,121.8,s,
C,14,23.99,s,
C,15,47.78,s,
C,16,36.3,s,
C,17,15.5,s,
C,18,38.2,s,
C,19,25.0,s,
C,20,81.7,s,
O,21,,,
C,22,104.6,s,
O,23,,,
C,24,75.96,s,
C,25,174.81,s,
O,26,,,
O,27,,,
C,28,72.75,s,
O,29,,,
C,30,77.91,s,
O,31,,,
C,32,75.0,s,
O,33,,,
C,34,55.6,s,
C,35,10.3,s,
C,36,,,
O,37,,,
C,38,47.6,s,
C,39,20.5,s,
C,40,33.45,s,
C,41,40.7,s,
C,42,18.0,s,
C,43,42.5,s,
C,44,27.1,s,
C,45,34.4,s,
C,46,72.0,s,
O,47,,,
H,48,0.94,s,
H,49,0.94,s,
H,50,0.94,s,
H,51,0.94,s,
H,52,0.94,s,
H,53,0.94,s,
H,54,2.43,ddd,"12.4,6.2,2.3"
H,55,2.43,ddd,"12.4,11.6,7.1"
H,56,2.22,ddd,"12.4,11.6,6.2"
H,57,2.22,ddd,"12.4,7.1,2.3"
H,58,,,
H,59,3.59,dd,"9.1,1.0"
H,60,2.82,dd,"12.4,9.1"
H,61,2.82,dd,"12.4,1.0"
H,62,5.43,dd,"4.7,2.7"
H,63,2.0,ddd,"15.4,12.7,2.7"
H,64,2.0,ddd,"15.4,7.3,4.7"
H,65,1.82,dd,"12.7,7.3"
H,66,1.15,s,
H,67,1.15,s,
H,68,1.15,s,
H,69,1.35,ddd,"12.4,10.4,8.3"
H,70,1.35,ddd,"12.4,8.7,1.0"
H,71,2.06,m,
H,72,2.06,m,
H,73,4.06,dd,"6.2,2.6"
H,74,4.68,d,9.0
H,75,3.88,d,1.5
H,76,,,
H,77,3.49,dd,"1.5,1.2"
H,78,,,
H,79,3.5,dd,"4.7,1.2"
H,80,,,
H,81,3.64,dd,"9.0,4.7"
H,82,,,
H,83,1.13,s,
H,84,1.13,s,
H,85,1.13,s,
H,86,9.78,s,
H,87,2.11,dd,"12.4,5.3"
H,88,1.69,tdd,"12.4,11.3,3.9"
H,89,1.69,m,
H,90,1.42,ddd,"12.4,11.3,3.2"
H,91,1.42,ddd,"12.4,12.1,3.9"
H,92,0.89,s,
H,93,0.89,s,
H,94,0.89,s,
H,95,1.18,s,
H,96,1.18,s,
H,97,1.18,s,
H,98,2.06,dd,"12.4,6.5"
H,99,2.06,dd,"12.4,9.5"
H,100,5.22,dd,"9.5,6.5"
H,101,,,
