C,1,52.15,s,
O,2,,,
C,3,174.3,s,
O,4,,,
C,5,32.5,s,
C,6,45.0,s,
C,7,46.2,s,
C,8,24.1,s,
C,9,24.1,s,
C,10,,,
O,11,,,
C,12,123.9,s,
C,13,152.8,s,
C,14,44.5,s,
C,15,23.4,s,
C,16,46.7,s,
C,17,128.7,s,
C,18,46.3,s,
Cl,19,,,
C,20,154.7,s,
C,21,69.7,s,
O,22,,,
C,23,40.8,s,
C,24,43.2,s,
C,25,122.5,s,
C,26,110.6,s,
C,27,142.5,s,
O,28,,,
C,29,140.2,s,
C,30,50.2,s,
C,31,17.0,s,
C,32,73.2,s,
O,33,,,
C,34,170.2,s,
C,35,20.9,s,
O,36,,,
C,37,70.5,s,
O,38,,,
C,39,169.6,s,
C,40,20.8,s,
O,41,,,
H,42,3.61,s,
H,43,3.61,s,
H,44,3.61,s,
H,45,2.6,d,6.5
H,46,2.6,d,6.5
H,47,1.5,t,6.5
H,48,1.11,s,
H,49,1.11,s,
H,50,1.11,s,
H,51,1.11,s,
H,52,1.11,s,
H,53,1.11,s,
H,54,5.88,d,12.0
H,55,6.3,d,12.0
H,56,0.99,s,
H,57,0.99,s,
H,58,0.99,s,
H,59,3.0,d,7.7
H,60,4.18,s,
H,61,4.18,s,
H,62,4.37,dd,"13.5,4.7"
H,63,,,
H,64,1.88,ddd,"12.4,4.7,1.6"
H,65,1.88,ddd,"13.5,12.4,8.8"
H,66,3.29,dd,"8.8,1.6"
H,67,6.28,dd,"2.7,1.9"
H,68,7.25,d,2.7
H,69,7.39,d,1.9
H,70,1.25,s,
H,71,1.25,s,
H,72,1.25,s,
H,73,4.77,d,10.0
H,74,2.0,s,
H,75,2.0,s,
H,76,2.0,s,
H,77,4.66,dd,"10.0,7.7"
H,78,2.03,s,
H,79,2.03,s,
H,80,2.03,s,
