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,12,68.9,s,
O,13,,,
C,14,165.1,s,
C,15,20.5,s,
O,16,,,
C,17,50.4,s,
C,18,73.8,s,
O,19,,,
C,20,170.1,s,
C,21,21.6,s,
O,22,,,
C,23,94.3,s,
O,24,,,
C,25,83.9,s,
C,26,18.5,s,
C,27,69.9,s,
O,28,,,
C,29,168.5,s,
O,30,,,
C,31,125.4,s,
C,32,137.6,s,
C,33,121.1,s,
C,34,151.35,s,
N,35,,,
C,36,165.0,s,
C,37,36.35,s,
C,38,11.85,s,
C,39,45.0,s,
C,40,9.3,s,
C,41,174.45,s,
O,42,,,
O,43,,,
C,44,75.2,s,
C,45,80.31,s,
O,46,,,
C,47,171.68,s,
C,48,20.88,s,
O,49,,,
C,50,71.6,s,
O,51,,,
C,52,169.2,s,
C,53,20.5,s,
O,54,,,
C,55,70.2,s,
C,56,23.17,s,
O,57,,,
H,58,2.07,s,
H,59,2.07,s,
H,60,2.07,s,
H,61,5.24,s,
H,62,5.24,s,
H,63,5.32,d,7.2
H,64,2.0,s,
H,65,2.0,s,
H,66,2.0,s,
H,67,5.54,dd,"7.2,1.2"
H,68,2.03,s,
H,69,2.03,s,
H,70,2.03,s,
H,71,2.33,dd,"3.3,1.2"
H,72,7.02,d,3.3
H,73,2.04,s,
H,74,2.04,s,
H,75,2.04,s,
H,76,1.69,s,
H,77,1.69,s,
H,78,1.69,s,
H,79,5.95,s,
H,80,5.95,s,
H,81,8.08,dd,"8.7,1.4"
H,82,7.27,dd,"8.7,4.1"
H,83,8.68,dd,"4.1,1.4"
H,84,4.66,dq,"11.5,6.7"
H,85,1.38,d,6.7
H,86,1.38,d,6.7
H,87,1.38,d,6.7
H,88,2.55,dq,"11.5,6.7"
H,89,1.21,d,6.7
H,90,1.21,d,6.7
H,91,1.21,d,6.7
H,92,4.75,d,5.1
H,93,5.21,dd,"7.6,5.1"
H,94,2.05,s,
H,95,2.05,s,
H,96,2.05,s,
H,97,5.71,d,7.6
H,98,2.0,s,
H,99,2.0,s,
H,100,2.0,s,
H,101,1.54,s,
H,102,1.54,s,
H,103,1.54,s,
H,104,,,
