C,1,22.7,s,
C,2,39.4,s,
C,3,22.7,s,
C,4,83.4,s,
O,5,,,
C,6,68.6,s,
O,7,,,
C,8,46.6,s,
C,9,38.35,s,
C,10,17.05,s,
C,11,54.35,s,
C,12,18.17,s,
C,13,32.72,s,
C,14,40.03,s,
C,15,16.93,s,
C,16,47.45,s,
C,17,23.77,s,
C,18,125.1,s,
C,19,140.9,s,
C,20,45.2,s,
C,21,42.6,s,
C,22,42.3,s,
C,23,20.5,s,
C,24,38.5,s,
C,25,84.7,s,
O,26,,,
C,27,180.6,s,
O,28,,,
C,29,36.1,s,
C,30,23.5,s,
C,31,26.6,s,
C,32,25.1,s,
C,33,39.7,s,
C,34,24.9,s,
H,35,1.29,s,
H,36,1.29,s,
H,37,1.29,s,
H,38,1.29,s,
H,39,1.29,s,
H,40,1.29,s,
H,41,3.44,d,3.5
H,42,,,
H,43,4.43,ddd,"11.4,6.3,3.5"
H,44,,,
H,45,2.35,dd,"12.4,6.3"
H,46,2.35,dd,"12.4,11.4"
H,47,1.49,s,
H,48,1.49,s,
H,49,1.49,s,
H,50,1.07,dd,"12.9,2.3"
H,51,1.46,ddt,"12.9,12.4,9.9"
H,52,1.46,m,
H,53,1.49,ddd,"12.4,9.9,2.0"
H,54,1.49,ddd,"12.4,9.9,8.9"
H,55,1.08,s,
H,56,1.08,s,
H,57,1.08,s,
H,58,1.63,dd,"13.4,3.9"
H,59,2.03,ddd,"15.4,13.4,2.7"
H,60,2.03,ddd,"15.4,6.1,3.9"
H,61,5.48,dd,"6.1,2.7"
H,62,2.94,dd,"11.1,9.3"
H,63,2.04,dd,"12.4,11.1"
H,64,2.04,dd,"12.4,9.3"
H,65,1.2,s,
H,66,1.2,s,
H,67,1.2,s,
H,68,2.1,dd,"12.4,0.6"
H,69,2.1,dd,"12.4,5.4"
H,70,4.77,dd,"5.4,0.6"
H,71,1.13,s,
H,72,1.13,s,
H,73,1.13,s,
H,74,1.72,ddd,"13.1,12.4,2.3"
H,75,1.72,ddd,"12.4,3.9,3.7"
H,76,1.61,ddd,"12.4,3.7,2.3"
H,77,1.61,ddd,"13.1,12.4,3.9"
H,78,1.31,s,
H,79,1.31,s,
H,80,1.31,s,
