C,1,21.23,s,
C,2,170.21,s,
O,3,,,
O,4,,,
C,5,77.06,s,
C,6,42.83,s,
C,7,45.8,s,
C,8,17.2,s,
C,9,51.2,s,
C,10,21.5,s,
C,11,21.5,s,
C,12,48.86,s,
C,13,37.91,s,
C,14,16.96,s,
C,15,35.28,s,
C,16,26.4,s,
C,17,46.95,s,
C,18,72.88,s,
C,19,27.77,s,
C,20,27.77,s,
O,21,,,
C,22,54.73,s,
C,23,72.59,s,
O,24,,,
C,25,43.26,s,
C,26,45.8,s,
C,27,17.2,s,
C,28,37.2,s,
C,29,17.0,s,
C,30,38.64,s,
C,31,18.79,s,
C,32,36.51,s,
C,33,44.68,s,
C,34,23.91,s,
C,35,183.36,s,
O,36,,,
O,37,,,
C,38,51.51,s,
H,39,2.02,s,
H,40,2.02,s,
H,41,2.02,s,
H,42,4.88,ddd,"5.7,3.3,3.0"
H,43,2.1,dd,"12.4,5.7"
H,44,2.1,dd,"12.4,3.0"
H,45,1.26,s,
H,46,1.26,s,
H,47,1.26,s,
H,48,1.47,dd,"10.0,9.0"
H,49,1.01,m,
H,50,1.01,m,
H,51,1.01,m,
H,52,1.01,m,
H,53,1.71,dd,"10.2,0.7"
H,54,0.94,s,
H,55,0.94,s,
H,56,0.94,s,
H,57,1.72,ddd,"12.4,3.2,1.3"
H,58,1.72,ddd,"13.0,12.4,7.3"
H,59,1.58,m,
H,60,1.58,m,
H,61,2.13,ddd,"12.5,5.4,4.4"
H,62,1.22,s,
H,63,1.22,s,
H,64,1.22,s,
H,65,1.22,s,
H,66,1.22,s,
H,67,1.22,s,
H,68,,,
H,69,1.86,dd,"6.5,5.4"
H,70,4.19,ddd,"9.4,6.5,1.7"
H,71,,,
H,72,1.76,dd,"12.4,9.4"
H,73,1.76,dd,"12.4,1.7"
H,74,1.26,s,
H,75,1.26,s,
H,76,1.26,s,
H,77,1.58,s,
H,78,1.58,s,
H,79,1.58,s,
H,80,1.55,ddd,"12.4,5.4,2.9"
H,81,1.55,ddd,"13.6,12.4,4.7"
H,82,1.63,m,
H,83,1.63,m,
H,84,2.02,ddd,"12.4,9.5,9.2"
H,85,2.02,ddd,"12.4,8.6,1.3"
H,86,1.3,s,
H,87,1.3,s,
H,88,1.3,s,
H,89,,,
H,90,2.9,d,3.3
