C,1,20.45,s,
C,2,169.75,s,
O,3,,,
O,4,,,
C,5,60.3,s,
C,6,52.5,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,14,175.7,s,
O,15,,,
C,16,34.1,s,
C,17,18.6,s,
C,18,18.6,s,
C,19,50.4,s,
C,20,73.8,s,
O,21,,,
C,22,170.1,s,
C,23,21.6,s,
O,24,,,
C,25,94.4,s,
O,26,,,
C,27,83.9,s,
C,28,18.5,s,
C,29,69.9,s,
O,30,,,
C,31,168.5,s,
O,32,,,
C,33,125.4,s,
C,34,137.6,s,
C,35,121.1,s,
C,36,151.35,s,
N,37,,,
C,38,165.0,s,
C,39,36.35,s,
C,40,11.85,s,
C,41,45.0,s,
C,42,9.3,s,
C,43,174.45,s,
O,44,,,
O,45,,,
C,46,77.9,s,
C,47,69.6,s,
O,48,,,
C,49,75.3,s,
O,50,,,
C,51,169.9,s,
C,52,21.4,s,
O,53,,,
C,54,70.4,s,
C,55,22.85,s,
O,56,,,
H,57,2.07,s,
H,58,2.07,s,
H,59,2.07,s,
H,60,5.24,s,
H,61,5.24,s,
H,62,5.32,d,1.7
H,63,2.0,s,
H,64,2.0,s,
H,65,2.0,s,
H,66,5.54,dd,"1.7,1.5"
H,67,2.54,m,6.6
H,68,1.14,d,6.6
H,69,1.14,d,6.6
H,70,1.14,d,6.6
H,71,1.14,d,6.6
H,72,1.14,d,6.6
H,73,1.14,d,6.6
H,74,2.33,dd,"3.4,1.5"
H,75,7.02,d,3.4
H,76,2.04,s,
H,77,2.04,s,
H,78,2.04,s,
H,79,1.69,s,
H,80,1.69,s,
H,81,1.69,s,
H,82,5.95,s,
H,83,5.95,s,
H,84,8.08,dd,"8.1,1.4"
H,85,7.27,dd,"8.1,4.3"
H,86,8.68,dd,"4.3,1.4"
H,87,4.66,qd,"6.7,4.9"
H,88,1.38,d,6.7
H,89,1.38,d,6.7
H,90,1.38,d,6.7
H,91,2.55,qd,"6.7,4.9"
H,92,1.21,d,6.7
H,93,1.21,d,6.7
H,94,1.21,d,6.7
H,95,4.76,d,8.6
H,96,3.94,dd,"8.6,3.7"
H,97,,,
H,98,4.77,d,3.7
H,99,2.0,s,
H,100,2.0,s,
H,101,2.0,s,
H,102,1.54,s,
H,103,1.54,s,
H,104,1.54,s,
H,105,,,
