C,1,20.95,s,
C,2,169.4,s,
O,3,,,
O,4,,,
C,5,72.19,s,
C,6,151.54,s,
C,7,138.17,s,
C,8,14.92,s,
C,9,199.7,s,
O,10,,,
C,11,37.0,s,
C,12,45.0,s,
C,13,68.0,s,
O,14,,,
C,15,169.35,s,
C,16,21.5,s,
O,17,,,
C,18,47.92,s,
C,19,58.58,s,
C,20,49.9,s,
O,21,,,
C,22,83.52,s,
O,23,,,
C,24,167.16,s,
O,25,,,
C,26,116.48,s,
C,27,144.96,s,
C,28,134.54,s,
C,29,128.46,s,
C,30,128.85,s,
C,31,128.93,s,
C,32,128.85,s,
C,33,128.46,s,
C,34,30.57,s,
C,35,27.96,s,
C,36,43.7,s,
C,37,17.3,s,
C,38,77.5,s,
O,39,,,
C,40,170.6,s,
C,41,20.72,s,
O,42,,,
C,43,37.9,s,
C,44,30.65,s,
C,45,30.65,s,
H,46,2.05,s,
H,47,2.05,s,
H,48,2.05,s,
H,49,6.14,d,8.2
H,50,1.83,s,
H,51,1.83,s,
H,52,1.83,s,
H,53,2.74,dd,"15.4,10.9"
H,54,2.74,dd,"15.4,2.0"
H,55,2.12,ddd,"10.9,3.4,2.0"
H,56,4.98,dd,"6.1,3.4"
H,57,2.06,s,
H,58,2.06,s,
H,59,2.06,s,
H,60,3.07,d,6.1
H,61,3.31,s,
H,62,3.31,s,
H,63,4.54,dd,"9.0,2.0"
H,64,6.4,d,16.0
H,65,7.7,d,16.0
H,66,7.58,m,
H,67,7.35,m,
H,68,7.31,ddt,"7.6,7.0,1.4"
H,69,7.35,m,
H,70,7.58,m,
H,71,1.8,ddt,"12.4,6.1,2.0"
H,72,1.8,m,
H,73,1.5,ddd,"12.4,10.8,6.1"
H,74,1.5,ddd,"12.4,8.4,2.0"
H,75,1.13,s,
H,76,1.13,s,
H,77,1.13,s,
H,78,5.97,d,8.2
H,79,2.0,s,
H,80,2.0,s,
H,81,2.0,s,
H,82,1.39,s,
H,83,1.39,s,
H,84,1.39,s,
H,85,1.39,s,
H,86,1.39,s,
H,87,1.39,s,
