C,1,16.35,s,
C,2,42.4,s,
C,3,28.56,s,
C,4,37.31,s,
C,5,48.9,s,
C,6,177.0,s,
O,7,,,
O,8,,,
C,9,95.3,s,
O,10,,,
C,11,78.59,s,
C,12,62.47,s,
O,13,,,
C,14,71.06,s,
O,15,,,
C,16,78.34,s,
O,17,,,
C,18,67.94,s,
O,19,,,
C,20,26.17,s,
C,21,28.48,s,
C,22,42.15,s,
C,23,24.65,s,
C,24,140.1,s,
C,25,127.6,s,
C,26,23.77,s,
C,27,47.45,s,
C,28,38.35,s,
C,29,17.05,s,
C,30,46.6,s,
C,31,68.6,s,
O,32,,,
C,33,83.4,s,
O,34,,,
C,35,39.4,s,
C,36,22.7,s,
C,37,22.7,s,
C,38,54.35,s,
C,39,18.17,s,
C,40,32.72,s,
C,41,40.4,s,
C,42,16.8,s,
C,43,54.6,s,
C,44,72.65,s,
C,45,27.1,s,
O,46,,,
H,47,1.05,d,6.6
H,48,1.05,d,6.6
H,49,1.05,d,6.6
H,50,1.19,qdd,"6.6,3.7,2.6"
H,51,1.77,m,
H,52,1.77,m,
H,53,1.72,ddd,"13.2,12.4,3.3"
H,54,1.72,ddd,"12.4,4.0,3.1"
H,55,6.34,d,1.4
H,56,3.93,td,"5.4,4.0"
H,57,4.04,d,5.4
H,58,4.04,d,5.4
H,59,,,
H,60,3.82,dd,"6.5,4.0"
H,61,,,
H,62,3.96,dd,"6.5,3.2"
H,63,,,
H,64,4.16,dd,"3.2,1.4"
H,65,,,
H,66,2.5,ddd,"12.4,5.8,4.3"
H,67,2.5,ddd,"12.6,12.4,5.6"
H,68,1.65,ddd,"12.4,5.6,4.3"
H,69,1.65,ddd,"12.6,12.4,5.8"
H,70,1.41,s,
H,71,1.41,s,
H,72,1.41,s,
H,73,5.52,dd,"5.6,2.6"
H,74,2.05,ddd,"15.4,5.6,2.3"
H,75,2.05,ddd,"15.4,14.0,2.6"
H,76,1.63,dd,"14.0,2.3"
H,77,1.49,s,
H,78,1.49,s,
H,79,1.49,s,
H,80,2.35,dd,"12.4,11.2"
H,81,2.35,dd,"12.4,5.6"
H,82,4.43,ddd,"11.2,5.6,3.4"
H,83,,,
H,84,3.44,d,3.4
H,85,,,
H,86,1.29,s,
H,87,1.29,s,
H,88,1.29,s,
H,89,1.29,s,
H,90,1.29,s,
H,91,1.29,s,
H,92,1.07,dd,"12.7,3.8"
H,93,1.46,m,
H,94,1.46,m,
H,95,1.49,ddd,"12.4,4.3,2.8"
H,96,1.49,ddd,"13.8,12.4,4.4"
H,97,1.08,s,
H,98,1.08,s,
H,99,1.08,s,
H,100,2.91,s,
H,101,1.3,s,
H,102,1.3,s,
H,103,1.3,s,
H,104,,,
