C,1,118.1,s,
C,2,141.4,s,
C,3,77.77,s,
O,4,,,
C,5,172.13,s,
O,6,,,
C,7,35.9,s,
C,8,65.9,s,
C,9,141.0,s,
C,10,130.1,s,
C,11,128.6,s,
C,12,128.18,s,
C,13,128.6,s,
C,14,130.1,s,
N,15,,,
C,16,40.55,s,
C,17,40.55,s,
C,18,27.58,s,
C,19,28.3,s,
C,20,43.21,s,
C,21,17.24,s,
C,22,76.38,s,
O,23,,,
C,24,170.15,s,
C,25,20.72,s,
O,26,,,
C,27,70.01,s,
O,28,,,
C,29,170.06,s,
C,30,20.95,s,
O,31,,,
C,32,130.06,s,
C,33,142.01,s,
C,34,12.5,s,
C,35,97.5,s,
O,36,,,
C,37,35.02,s,
C,38,37.97,s,
C,39,71.06,s,
O,40,,,
C,41,170.01,s,
C,42,21.15,s,
O,43,,,
C,44,46.29,s,
C,45,40.08,s,
C,46,17.17,s,
C,47,76.38,s,
O,48,,,
H,49,5.0,s,
H,50,5.0,s,
H,51,5.28,dd,"8.0,7.7"
H,52,3.03,d,6.2
H,53,3.03,d,6.2
H,54,3.73,t,6.2
H,55,7.26,m,
H,56,7.35,m,
H,57,7.28,tt,"7.8,1.4"
H,58,7.35,m,
H,59,7.26,m,
H,60,2.19,s,
H,61,2.19,s,
H,62,2.19,s,
H,63,2.19,s,
H,64,2.19,s,
H,65,2.19,s,
H,66,1.4,m,
H,67,1.4,m,
H,68,1.5,ddd,"12.4,9.7,7.4"
H,69,1.5,ddd,"12.4,10.2,1.6"
H,70,0.83,s,
H,71,0.83,s,
H,72,0.83,s,
H,73,5.97,d,7.6
H,74,2.0,s,
H,75,2.0,s,
H,76,2.0,s,
H,77,6.14,d,7.6
H,78,2.05,s,
H,79,2.05,s,
H,80,2.05,s,
H,81,1.92,s,
H,82,1.92,s,
H,83,1.92,s,
H,84,,,
H,85,2.27,dd,"12.4,6.5"
H,86,2.27,dd,"13.6,12.4"
H,87,2.12,ddd,"13.6,12.0,6.5"
H,88,5.56,dd,"12.0,5.9"
H,89,2.01,s,
H,90,2.01,s,
H,91,2.01,s,
H,92,3.09,d,5.9
H,93,1.13,s,
H,94,1.13,s,
H,95,1.13,s,
H,96,4.13,s,
H,97,4.13,s,
