C,1,20.86,s,
C,2,170.74,s,
O,3,,,
O,4,,,
C,5,72.44,s,
C,6,42.43,s,
C,7,25.54,s,
C,8,35.28,s,
C,9,37.32,s,
C,10,32.5,s,
C,11,28.4,s,
C,12,26.75,s,
C,13,25.84,s,
C,14,41.9,s,
C,15,25.9,s,
C,16,145.1,s,
C,17,121.7,s,
C,18,24.0,s,
C,19,47.45,s,
C,20,39.8,s,
C,21,17.6,s,
C,22,33.41,s,
C,23,18.82,s,
C,24,51.09,s,
C,25,43.25,s,
C,26,23.65,s,
C,27,65.75,s,
O,28,,,
C,29,85.6,s,
O,30,,,
C,31,68.7,s,
O,32,,,
C,33,46.6,s,
C,34,38.35,s,
C,35,17.05,s,
C,36,46.64,s,
C,37,42.11,s,
H,38,2.07,s,
H,39,2.07,s,
H,40,2.07,s,
H,41,4.13,s,
H,42,4.13,s,
H,43,1.13,s,
H,44,1.13,s,
H,45,1.13,s,
H,46,1.72,ddd,"12.4,10.9,7.8"
H,47,1.72,ddd,"12.4,7.1,2.4"
H,48,1.49,ddd,"12.4,7.8,2.4"
H,49,1.49,ddd,"12.4,10.9,7.1"
H,50,0.95,s,
H,51,0.95,s,
H,52,0.95,s,
H,53,1.54,ddd,"12.4,10.6,8.4"
H,54,1.54,ddd,"12.4,9.8,1.2"
H,55,1.63,ddd,"12.4,9.8,8.4"
H,56,1.63,ddd,"12.4,10.6,1.2"
H,57,1.27,s,
H,58,1.27,s,
H,59,1.27,s,
H,60,5.43,dd,"5.0,3.0"
H,61,2.03,ddd,"15.4,6.2,3.0"
H,62,2.03,ddd,"15.4,11.5,5.0"
H,63,1.63,dd,"11.5,6.2"
H,64,1.08,s,
H,65,1.08,s,
H,66,1.08,s,
H,67,1.47,ddd,"12.4,6.2,4.1"
H,68,1.47,ddd,"12.8,12.4,4.9"
H,69,1.52,m,
H,70,1.52,m,
H,71,1.76,dd,"9.6,9.4"
H,72,1.24,s,
H,73,1.24,s,
H,74,1.24,s,
H,75,4.03,s,
H,76,4.03,s,
H,77,,,
H,78,4.13,d,3.5
H,79,,,
H,80,3.59,ddd,"11.2,3.5,3.3"
H,81,,,
H,82,2.21,dd,"12.4,11.2"
H,83,2.21,dd,"12.4,3.3"
H,84,1.5,s,
H,85,1.5,s,
H,86,1.5,s,
H,87,2.94,dd,"11.5,2.5"
H,88,2.04,dd,"12.4,11.5"
H,89,2.04,dd,"12.4,2.5"
