C,1,29.3,s,
C,2,32.23,s,
C,3,29.3,s,
C,4,44.6,s,
C,5,45.2,s,
C,6,140.9,s,
C,7,125.1,s,
C,8,23.9,s,
C,9,47.6,s,
C,10,36.6,s,
C,11,15.5,s,
C,12,38.8,s,
C,13,26.5,s,
C,14,90.4,s,
O,15,,,
C,16,107.46,s,
O,17,,,
C,18,66.98,s,
C,19,70.91,s,
O,20,,,
C,21,77.76,s,
O,22,,,
C,23,74.92,s,
O,24,,,
C,25,44.1,s,
C,26,23.1,s,
C,27,63.2,s,
O,28,,,
C,29,56.3,s,
C,30,18.7,s,
C,31,33.4,s,
C,32,42.9,s,
C,33,16.58,s,
C,34,39.7,s,
C,35,24.9,s,
C,36,25.1,s,
C,37,26.6,s,
C,38,41.75,s,
C,39,10.65,s,
C,40,76.5,s,
O,41,,,
C,42,42.83,s,
H,43,1.09,s,
H,44,1.09,s,
H,45,1.09,s,
H,46,1.09,s,
H,47,1.09,s,
H,48,1.09,s,
H,49,1.34,dd,"12.4,8.9"
H,50,1.34,dd,"12.4,0.7"
H,51,2.94,dd,"8.9,0.7"
H,52,5.48,dd,"5.3,2.9"
H,53,1.93,ddd,"15.4,7.5,5.3"
H,54,1.93,ddd,"15.4,10.6,2.9"
H,55,1.81,dd,"10.6,7.5"
H,56,0.9,s,
H,57,0.9,s,
H,58,0.9,s,
H,59,1.97,td,"12.4,6.0"
H,60,1.97,ddd,"12.4,6.2,2.7"
H,61,2.06,tdd,"12.4,7.1,6.2"
H,62,2.06,m,
H,63,4.18,dd,"9.2,7.1"
H,64,4.7,d,5.4
H,65,4.14,dd,"9.4,4.8"
H,66,4.14,dd,"9.4,0.9"
H,67,4.09,ddd,"5.6,4.8,0.9"
H,68,,,
H,69,4.04,dd,"9.5,5.6"
H,70,,,
H,71,3.92,dd,"9.5,5.4"
H,72,,,
H,73,0.88,s,
H,74,0.88,s,
H,75,0.88,s,
H,76,4.28,s,
H,77,4.28,s,
H,78,,,
H,79,1.76,dd,"11.6,2.8"
H,80,1.52,m,
H,81,1.52,m,
H,82,1.47,ddd,"13.1,12.4,6.7"
H,83,1.47,ddd,"12.4,6.0,2.5"
H,84,1.08,s,
H,85,1.08,s,
H,86,1.08,s,
H,87,1.31,s,
H,88,1.31,s,
H,89,1.31,s,
H,90,1.61,ddd,"12.4,10.0,8.5"
H,91,1.61,ddd,"12.4,9.1,2.0"
H,92,1.72,ddd,"12.4,10.0,9.1"
H,93,1.72,ddd,"12.4,8.5,2.0"
H,94,1.13,s,
H,95,1.13,s,
H,96,1.13,s,
H,97,4.12,dd,"11.9,3.4"
H,98,,,
H,99,2.1,dd,"12.4,11.9"
H,100,2.1,dd,"12.4,3.4"
