C,1,16.9,s,
C,2,39.2,s,
C,3,53.1,s,
C,4,138.15,s,
C,5,125.44,s,
C,6,24.28,s,
C,7,51.21,s,
C,8,37.04,s,
C,9,14.13,s,
C,10,38.1,s,
C,11,35.23,s,
C,12,,,
O,13,,,
C,14,48.29,s,
C,15,23.04,s,
C,16,23.04,s,
C,17,48.76,s,
C,18,35.12,s,
C,19,75.84,s,
O,20,,,
C,21,47.72,s,
C,22,17.01,s,
C,23,44.35,s,
C,24,24.38,s,
C,25,27.77,s,
C,26,23.9,s,
C,27,48.4,s,
C,28,180.3,s,
O,29,,,
O,30,,,
C,31,36.8,s,
C,32,30.7,s,
C,33,38.9,s,
C,34,20.95,s,
H,35,0.8,d,6.6
H,36,0.8,d,6.6
H,37,0.8,d,6.6
H,38,1.39,qdd,"6.6,6.0,2.7"
H,39,2.79,d,6.0
H,40,5.48,dd,"4.9,2.9"
H,41,2.0,ddd,"15.4,12.5,2.9"
H,42,2.0,ddd,"15.4,5.7,4.9"
H,43,1.45,dd,"12.5,5.7"
H,44,1.15,s,
H,45,1.15,s,
H,46,1.15,s,
H,47,1.72,ddd,"12.4,11.2,1.8"
H,48,1.72,ddd,"12.4,11.1,8.4"
H,49,2.57,ddd,"15.4,11.2,8.4"
H,50,2.57,ddd,"15.4,11.1,1.8"
H,51,1.08,s,
H,52,1.08,s,
H,53,1.08,s,
H,54,1.08,s,
H,55,1.08,s,
H,56,1.08,s,
H,57,1.54,dd,"12.0,6.2"
H,58,1.92,ddd,"12.4,12.0,6.4"
H,59,1.92,ddd,"12.4,6.2,2.6"
H,60,4.33,dd,"6.4,2.6"
H,61,,,
H,62,1.25,s,
H,63,1.25,s,
H,64,1.25,s,
H,65,1.26,s,
H,66,1.26,s,
H,67,1.26,s,
H,68,1.61,ddd,"12.4,7.4,2.8"
H,69,1.61,ddd,"12.4,12.3,5.7"
H,70,2.31,ddd,"12.4,12.3,7.4"
H,71,2.31,ddd,"12.4,5.7,2.8"
H,72,,,
H,73,1.72,ddd,"12.4,4.9,3.4"
H,74,1.72,ddd,"13.8,12.4,2.5"
H,75,1.61,m,
H,76,1.61,m,
H,77,0.95,m,
H,78,0.95,d,6.5
H,79,0.95,d,6.5
H,80,0.95,d,6.5
