C,1,16.82,s,
C,2,38.84,s,
C,3,38.68,s,
C,4,20.95,s,
C,5,30.39,s,
C,6,36.29,s,
C,7,47.73,s,
C,8,177.0,s,
O,9,,,
O,10,,,
C,11,95.3,s,
O,12,,,
C,13,78.59,s,
C,14,62.47,s,
O,15,,,
C,16,71.06,s,
O,17,,,
C,18,78.34,s,
O,19,,,
C,20,67.94,s,
O,21,,,
C,22,26.17,s,
C,23,35.28,s,
C,24,63.6,s,
C,25,179.7,s,
O,26,,,
O,27,,,
C,28,149.11,s,
C,29,123.25,s,
C,30,23.77,s,
C,31,47.79,s,
C,32,36.92,s,
C,33,15.59,s,
C,34,38.52,s,
C,35,27.2,s,
C,36,78.78,s,
O,37,,,
C,38,38.55,s,
C,39,21.96,s,
C,40,21.96,s,
C,41,55.05,s,
C,42,18.17,s,
C,43,33.77,s,
C,44,43.99,s,
C,45,17.82,s,
C,46,52.74,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,qdd,"6.6,5.0,1.8"
H,51,0.95,m,
H,52,0.95,d,6.5
H,53,0.95,d,6.5
H,54,0.95,d,6.5
H,55,1.61,ddt,"12.4,6.8,0.9"
H,56,1.61,m,
H,57,1.72,ddd,"12.4,8.9,0.9"
H,58,1.72,ddd,"12.4,11.5,6.8"
H,59,6.34,d,8.8
H,60,3.93,td,"5.4,2.8"
H,61,4.04,d,5.4
H,62,4.04,d,5.4
H,63,,,
H,64,3.82,dd,"8.0,2.8"
H,65,,,
H,66,3.96,dd,"10.2,8.0"
H,67,,,
H,68,4.16,dd,"10.2,8.8"
H,69,,,
H,70,2.31,ddd,"12.4,4.6,2.4"
H,71,2.31,ddd,"13.0,12.4,5.1"
H,72,1.72,ddd,"12.4,5.1,2.4"
H,73,1.72,ddd,"13.0,12.4,4.6"
H,74,,,
H,75,5.48,dd,"4.8,3.2"
H,76,1.93,ddd,"15.4,9.9,3.2"
H,77,1.93,ddd,"15.4,7.8,4.8"
H,78,1.76,dd,"9.9,7.8"
H,79,0.88,s,
H,80,0.88,s,
H,81,0.88,s,
H,82,1.62,ddd,"12.4,5.3,2.8"
H,83,1.62,ddd,"12.6,12.4,5.7"
H,84,1.74,m,
H,85,1.74,m,
H,86,3.32,dd,"9.4,7.2"
H,87,,,
H,88,0.94,s,
H,89,0.94,s,
H,90,0.94,s,
H,91,0.94,s,
H,92,0.94,s,
H,93,0.94,s,
H,94,0.9,dd,"12.4,2.8"
H,95,1.46,dtd,"12.8,12.4,5.7"
H,96,1.46,m,
H,97,1.59,ddd,"12.4,5.7,1.9"
H,98,1.59,ddd,"12.8,12.4,5.9"
H,99,1.02,s,
H,100,1.02,s,
H,101,1.02,s,
H,102,2.79,d,5.0
