C,1,21.0,s,
C,2,170.1,s,
O,3,,,
O,4,,,
C,5,73.8,s,
C,6,23.5,s,
C,7,44.07,s,
C,8,42.7,s,
C,9,23.02,s,
C,10,23.02,s,
C,11,,,
O,12,,,
C,13,123.4,s,
C,14,161.2,s,
C,15,40.5,s,
C,16,20.3,s,
C,17,37.3,s,
C,18,16.0,s,
C,19,37.39,s,
C,20,39.94,s,
C,21,20.6,s,
C,22,159.3,s,
C,23,118.0,s,
C,24,34.8,s,
C,25,50.54,s,
C,26,41.19,s,
C,27,70.43,s,
O,28,,,
C,29,76.51,s,
C,30,75.4,s,
O,31,,,
C,32,73.1,s,
C,33,26.45,s,
C,34,26.45,s,
O,35,,,
C,36,35.12,s,
C,37,47.0,s,
C,38,24.9,s,
H,39,2.01,s,
H,40,2.01,s,
H,41,2.01,s,
H,42,4.77,dd,"3.7,1.7"
H,43,1.88,ddd,"12.5,12.4,1.7"
H,44,1.88,ddd,"12.4,4.9,3.7"
H,45,1.5,dd,"12.5,4.9"
H,46,1.11,s,
H,47,1.11,s,
H,48,1.11,s,
H,49,1.11,s,
H,50,1.11,s,
H,51,1.11,s,
H,52,5.88,d,12.0
H,53,6.3,d,12.0
H,54,1.27,s,
H,55,1.27,s,
H,56,1.27,s,
H,57,2.21,dd,"12.8,4.5"
H,58,1.85,m,
H,59,1.85,m,
H,60,2.1,ddd,"12.4,12.2,3.0"
H,61,2.1,ddd,"12.4,12.0,4.9"
H,62,1.01,s,
H,63,1.01,s,
H,64,1.01,s,
H,65,5.3,dd,"5.4,2.6"
H,66,2.63,ddd,"12.4,5.4,4.9"
H,67,2.63,ddd,"13.6,12.4,2.6"
H,68,1.61,ddd,"13.6,5.6,4.9"
H,69,2.3,m,
H,70,4.04,dd,"6.4,4.8"
H,71,4.04,dd,"6.4,0.4"
H,72,4.61,ddd,"10.9,6.3,4.8"
H,73,4.12,d,4.8
H,74,,,
H,75,1.3,s,
H,76,1.3,s,
H,77,1.3,s,
H,78,1.3,s,
H,79,1.3,s,
H,80,1.3,s,
H,81,,,
H,82,1.88,ddd,"12.4,10.9,6.4"
H,83,1.88,ddd,"12.4,6.3,0.6"
H,84,1.18,s,
H,85,1.18,s,
H,86,1.18,s,
