C,1,15.2,s,
C,2,39.7,s,
C,3,76.5,s,
O,4,,,
C,5,31.2,s,
C,6,38.2,s,
C,7,41.58,s,
C,8,13.76,s,
C,9,50.54,s,
C,10,21.4,s,
C,11,33.77,s,
C,12,38.98,s,
C,13,18.17,s,
C,14,49.59,s,
C,15,42.11,s,
C,16,42.43,s,
C,17,25.54,s,
C,18,70.96,s,
O,19,,,
C,20,35.28,s,
C,21,37.32,s,
C,22,29.98,s,
C,23,32.08,s,
C,24,36.01,s,
C,25,29.69,s,
C,26,43.99,s,
C,27,17.82,s,
C,28,50.54,s,
C,29,28.55,s,
C,30,26.89,s,
C,31,50.7,s,
H,32,1.03,d,6.6
H,33,1.03,d,6.6
H,34,1.03,d,6.6
H,35,1.43,qdd,"6.6,5.8,2.3"
H,36,3.14,ddd,"9.5,5.8,4.6"
H,37,,,
H,38,1.58,m,
H,39,1.58,m,
H,40,1.72,ddd,"12.4,12.0,6.7"
H,41,1.72,ddd,"12.4,5.5,2.5"
H,42,0.74,s,
H,43,0.74,s,
H,44,0.74,s,
H,45,1.61,ddd,"11.0,10.2,4.3"
H,46,1.47,m,
H,47,1.47,m,
H,48,1.59,ddd,"12.4,10.6,1.2"
H,49,1.59,ddd,"12.4,9.1,8.1"
H,50,1.03,s,
H,51,1.03,s,
H,52,1.03,s,
H,53,1.63,dd,"11.7,3.7"
H,54,2.04,dd,"12.4,11.7"
H,55,2.04,dd,"12.4,3.7"
H,56,1.13,s,
H,57,1.13,s,
H,58,1.13,s,
H,59,3.97,s,
H,60,3.97,s,
H,61,,,
H,62,1.72,ddd,"12.4,6.9,3.2"
H,63,1.72,ddd,"12.8,12.4,3.7"
H,64,1.49,ddd,"12.8,12.4,6.9"
H,65,1.49,ddd,"12.4,3.7,3.2"
H,66,1.18,s,
H,67,1.18,s,
H,68,1.18,s,
H,69,1.46,ddd,"12.4,10.2,9.4"
H,70,1.46,ddd,"12.4,8.2,1.6"
H,71,1.55,ddd,"12.4,10.2,8.2"
H,72,1.55,ddd,"12.4,9.4,1.6"
H,73,1.02,s,
H,74,1.02,s,
H,75,1.02,s,
H,76,1.61,ddd,"13.0,10.2,5.6"
H,77,1.68,m,
H,78,1.68,m,
H,79,1.62,m,
H,80,1.62,m,
H,81,1.61,ddd,"12.6,7.8,2.3"
