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,21,40.64,s,
C,22,13.34,s,
C,23,38.23,s,
C,24,19.23,s,
C,25,142.78,s,
C,26,123.8,s,
C,27,146.7,s,
N,28,,,
C,29,149.83,s,
C,30,120.25,s,
C,31,163.6,s,
O,32,,,
O,33,,,
C,34,70.07,s,
C,35,85.37,s,
C,36,19.2,s,
O,37,,,
C,38,93.16,s,
C,39,76.6,s,
O,40,,,
C,41,40.4,s,
C,42,70.57,s,
O,43,,,
C,44,165.1,s,
C,45,20.5,s,
O,46,,,
C,47,71.4,s,
O,48,,,
C,49,169.05,s,
C,50,21.15,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,4.3
H,61,2.0,s,
H,62,2.0,s,
H,63,2.0,s,
H,64,5.21,dd,"10.3,4.3"
H,65,2.05,s,
H,66,2.05,s,
H,67,2.05,s,
H,68,4.75,d,10.3
H,69,2.63,dq,"11.3,6.7"
H,70,1.25,d,6.7
H,71,1.25,d,6.7
H,72,1.25,d,6.7
H,73,3.1,dq,"11.3,6.7"
H,74,1.24,d,6.7
H,75,1.24,d,6.7
H,76,1.24,d,6.7
H,77,7.07,d,5.4
H,78,8.6,d,5.4
H,79,9.09,s,
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,85,3.82,d,2.0
H,86,,,
H,87,2.83,dd,"2.0,1.7"
H,88,5.54,dd,"2.6,1.7"
H,89,2.03,s,
H,90,2.03,s,
H,91,2.03,s,
H,92,5.32,d,2.6
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,,,
