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,7,71.4,s,
O,8,,,
C,9,169.05,s,
C,10,21.15,s,
O,11,,,
C,12,70.57,s,
O,13,,,
C,14,165.1,s,
C,15,20.5,s,
O,16,,,
C,17,40.4,s,
C,18,76.6,s,
O,19,,,
C,20,93.16,s,
O,21,,,
C,22,85.37,s,
C,23,19.2,s,
C,24,70.07,s,
O,25,,,
C,26,168.5,s,
O,27,,,
C,28,125.4,s,
C,29,137.6,s,
C,30,121.1,s,
C,31,151.35,s,
N,32,,,
C,33,165.0,s,
C,34,36.35,s,
C,35,11.85,s,
C,36,45.0,s,
C,37,9.3,s,
C,38,174.45,s,
O,39,,,
O,40,,,
C,41,75.2,s,
C,42,80.31,s,
O,43,,,
C,44,171.68,s,
C,45,20.88,s,
O,46,,,
C,47,71.6,s,
O,48,,,
C,49,169.2,s,
C,50,20.5,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,60,5.32,d,8.3
H,61,2.0,s,
H,62,2.0,s,
H,63,2.0,s,
H,64,5.54,dd,"8.3,0.6"
H,65,2.03,s,
H,66,2.03,s,
H,67,2.03,s,
H,68,2.83,dd,"3.8,0.6"
H,69,3.82,d,3.8
H,70,,,
H,71,1.69,s,
H,72,1.69,s,
H,73,1.69,s,
H,74,5.95,s,
H,75,5.95,s,
H,76,8.08,dd,"9.0,1.4"
H,77,7.27,dd,"9.0,4.4"
H,78,8.68,dd,"4.4,1.4"
H,79,4.66,qd,"6.7,2.3"
H,80,1.38,d,6.7
H,81,1.38,d,6.7
H,82,1.38,d,6.7
H,83,2.55,qd,"6.7,2.3"
H,84,1.21,d,6.7
H,85,1.21,d,6.7
H,86,1.21,d,6.7
H,87,4.75,d,9.9
H,88,5.21,dd,"9.9,8.6"
H,89,2.05,s,
H,90,2.05,s,
H,91,2.05,s,
H,92,5.71,d,8.6
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,,,
