C,1,20.45,s,
C,2,169.75,s,
O,3,,,
O,4,,,
C,5,60.45,s,
C,6,52.75,s,
C,7,71.6,s,
O,8,,,
C,9,169.2,s,
C,10,20.5,s,
O,11,,,
C,12,80.31,s,
O,13,,,
C,14,171.68,s,
C,15,20.88,s,
O,16,,,
C,17,75.2,s,
O,18,,,
C,19,174.45,s,
O,20,,,
C,21,45.0,s,
C,22,9.3,s,
C,23,36.35,s,
C,24,11.85,s,
C,25,165.0,s,
N,26,,,
C,27,151.35,s,
C,28,121.1,s,
C,29,137.6,s,
C,30,125.4,s,
C,31,168.5,s,
O,32,,,
O,33,,,
C,34,70.2,s,
C,35,84.2,s,
C,36,18.3,s,
O,37,,,
C,38,94.3,s,
C,39,74.4,s,
O,40,,,
C,41,170.1,s,
C,42,21.6,s,
O,43,,,
C,44,50.4,s,
C,45,74.22,s,
O,46,,,
C,47,76.9,s,
O,48,,,
C,49,169.89,s,
C,50,20.79,s,
O,51,,,
C,52,70.2,s,
C,53,23.17,s,
O,54,,,
H,55,2.07,s,
H,56,2.07,s,
H,57,2.07,s,
H,58,5.24,s,
H,59,5.24,s,
H,60,5.71,d,9.3
H,61,2.0,s,
H,62,2.0,s,
H,63,2.0,s,
H,64,5.21,dd,"9.3,5.4"
H,65,2.05,s,
H,66,2.05,s,
H,67,2.05,s,
H,68,4.75,d,5.4
H,69,2.55,dq,"11.4,6.7"
H,70,1.21,d,6.7
H,71,1.21,d,6.7
H,72,1.21,d,6.7
H,73,4.66,dq,"11.4,6.7"
H,74,1.38,d,6.7
H,75,1.38,d,6.7
H,76,1.38,d,6.7
H,77,8.68,dd,"4.8,1.4"
H,78,7.27,dd,"9.1,4.8"
H,79,8.08,dd,"9.1,1.4"
H,80,5.95,s,
H,81,5.95,s,
H,82,1.69,s,
H,83,1.69,s,
H,84,1.69,s,
H,85,7.02,d,2.8
H,86,2.04,s,
H,87,2.04,s,
H,88,2.04,s,
H,89,2.83,dd,"6.1,2.8"
H,90,4.19,dd,"6.1,5.3"
H,91,,,
H,92,4.77,d,5.3
H,93,2.0,s,
H,94,2.0,s,
H,95,2.0,s,
H,96,1.54,s,
H,97,1.54,s,
H,98,1.54,s,
H,99,,,
