C,1,57.01,s,
O,2,,,
C,3,78.54,s,
C,4,130.07,s,
C,5,149.11,s,
C,6,47.74,s,
C,7,45.65,s,
C,8,30.74,s,
C,9,28.48,s,
C,10,28.48,s,
C,11,33.17,s,
C,12,30.16,s,
C,13,45.1,s,
C,14,61.77,s,
O,15,,,
C,16,29.4,s,
C,17,27.77,s,
C,18,42.15,s,
C,19,24.21,s,
C,20,43.99,s,
C,21,17.82,s,
C,22,33.77,s,
C,23,18.82,s,
C,24,51.09,s,
C,25,41.58,s,
C,26,13.76,s,
C,27,38.2,s,
C,28,26.42,s,
C,29,76.47,s,
O,30,,,
C,31,43.08,s,
C,32,20.83,s,
C,33,66.35,s,
O,34,,,
C,35,54.99,s,
H,36,3.2,s,
H,37,3.2,s,
H,38,3.2,s,
H,39,5.13,dd,"5.9,3.2"
H,40,5.77,d,5.9
H,41,2.94,dd,"10.8,8.3"
H,42,2.22,dd,"12.4,8.3"
H,43,2.22,dd,"12.4,10.8"
H,44,0.94,s,
H,45,0.94,s,
H,46,0.94,s,
H,47,0.94,s,
H,48,0.94,s,
H,49,0.94,s,
H,50,1.63,ddd,"12.4,5.2,3.1"
H,51,1.63,ddd,"12.6,12.4,5.1"
H,52,1.72,ddd,"12.6,12.4,5.2"
H,53,1.72,ddd,"12.4,5.1,3.1"
H,54,3.84,s,
H,55,3.84,s,
H,56,,,
H,57,2.0,ddd,"12.4,7.2,0.9"
H,58,2.0,ddd,"12.4,11.8,0.5"
H,59,1.61,ddd,"12.4,11.8,0.9"
H,60,1.61,ddd,"12.4,7.2,0.5"
H,61,1.31,s,
H,62,1.31,s,
H,63,1.31,s,
H,64,1.02,s,
H,65,1.02,s,
H,66,1.02,s,
H,67,1.59,ddd,"12.4,7.1,2.0"
H,68,1.59,ddd,"12.4,11.3,8.2"
H,69,1.52,m,
H,70,1.52,m,
H,71,1.76,dd,"12.7,4.4"
H,72,0.74,s,
H,73,0.74,s,
H,74,0.74,s,
H,75,1.72,ddd,"12.4,9.4,8.1"
H,76,1.72,ddd,"12.4,10.9,1.7"
H,77,1.75,m,
H,78,1.75,m,
H,79,3.69,dd,"8.3,1.5"
H,80,,,
H,81,1.18,s,
H,82,1.18,s,
H,83,1.18,s,
H,84,3.77,s,
H,85,3.77,s,
H,86,,,
H,87,2.65,d,3.2
