C,1,20.79,s,
C,2,169.89,s,
O,3,,,
O,4,,,
C,5,76.9,s,
C,6,52.9,s,
O,7,,,
C,8,55.37,s,
C,9,35.12,s,
C,10,57.29,s,
C,11,,,
O,12,,,
C,13,75.15,s,
O,14,,,
C,15,42.3,s,
C,16,54.73,s,
C,17,79.25,s,
O,18,,,
C,19,171.8,s,
O,20,,,
C,21,60.6,s,
O,22,,,
C,23,76.9,s,
O,24,,,
C,25,169.89,s,
C,26,20.79,s,
O,27,,,
C,28,42.47,s,
C,29,13.85,s,
C,30,54.73,s,
C,31,74.81,s,
O,32,,,
C,33,170.02,s,
C,34,21.57,s,
O,35,,,
C,36,54.73,s,
C,37,48.03,s,
C,38,38.17,s,
C,39,17.28,s,
C,40,109.36,s,
C,41,174.24,s,
O,42,,,
C,43,172.75,s,
O,44,,,
C,45,77.48,s,
C,46,25.81,s,
O,47,,,
C,48,41.86,s,
C,49,23.79,s,
C,50,42.4,s,
C,51,16.87,s,
H,52,2.0,s,
H,53,2.0,s,
H,54,2.0,s,
H,55,4.77,d,0.9
H,56,4.52,dd,"7.9,0.9"
H,57,3.44,ddd,"9.4,7.9,5.5"
H,58,1.88,ddd,"12.4,9.4,1.9"
H,59,1.88,ddd,"12.4,10.6,5.5"
H,60,2.69,dd,"10.6,1.9"
H,61,4.92,d,10.7
H,62,,,
H,63,2.42,ddd,"13.2,10.7,6.9"
H,64,1.86,dd,"13.2,9.9"
H,65,5.72,dd,"9.9,3.8"
H,66,4.35,s,
H,67,4.35,s,
H,68,,,
H,69,4.77,d,3.8
H,70,2.0,s,
H,71,2.0,s,
H,72,2.0,s,
H,73,1.18,s,
H,74,1.18,s,
H,75,1.18,s,
H,76,1.86,dd,"6.9,3.8"
H,77,4.98,dd,"4.7,3.8"
H,78,2.06,s,
H,79,2.06,s,
H,80,2.06,s,
H,81,1.86,dd,"7.7,4.7"
H,82,2.01,dd,"11.9,7.7"
H,83,2.33,dqd,"11.9,6.8,2.8"
H,84,1.01,d,6.8
H,85,1.01,d,6.8
H,86,1.01,d,6.8
H,87,6.02,d,2.8
H,88,1.4,s,
H,89,1.4,s,
H,90,1.4,s,
H,91,,,
H,92,1.13,s,
H,93,1.13,s,
H,94,1.13,s,
H,95,1.35,s,
H,96,1.35,s,
H,97,1.35,s,
