C,1,20.18,s,
C,2,28.67,s,
C,3,20.18,s,
C,4,41.63,s,
C,5,10.58,s,
C,6,75.45,s,
O,7,,,
C,8,73.62,s,
O,9,,,
C,10,39.26,s,
C,11,12.38,s,
C,12,52.93,s,
C,13,27.97,s,
C,14,24.74,s,
C,15,57.4,s,
C,16,35.9,s,
C,17,29.85,s,
C,18,28.59,s,
C,19,42.85,s,
C,20,35.12,s,
C,21,70.34,s,
O,22,,,
C,23,71.21,s,
O,24,,,
C,25,46.97,s,
C,26,36.9,s,
C,27,15.6,s,
C,28,54.4,s,
C,29,21.64,s,
C,30,40.98,s,
C,31,43.1,s,
C,32,11.97,s,
H,33,0.95,d,6.4
H,34,0.95,d,6.4
H,35,0.95,d,6.4
H,36,1.61,m,"6.4,5.3"
H,37,0.95,d,6.4
H,38,0.95,d,6.4
H,39,0.95,d,6.4
H,40,1.22,qdd,"6.6,5.3,5.1"
H,41,0.85,d,6.6
H,42,0.85,d,6.6
H,43,0.85,d,6.6
H,44,3.72,dd,"5.1,4.8"
H,45,,,
H,46,3.56,dd,"5.1,4.8"
H,47,,,
H,48,1.5,qdd,"6.6,5.6,5.1"
H,49,0.91,d,6.6
H,50,0.91,d,6.6
H,51,0.91,d,6.6
H,52,1.58,ddd,"10.3,5.6,4.9"
H,53,1.62,m,
H,54,1.62,m,
H,55,1.32,m,
H,56,1.32,m,
H,57,1.02,ddd,"12.6,7.9,5.5"
H,58,1.39,m,
H,59,1.33,dtd,"12.4,5.7,2.0"
H,60,1.33,tdd,"12.7,12.4,5.4"
H,61,1.47,m,
H,62,1.47,m,
H,63,1.09,m,
H,64,1.89,ddd,"12.4,11.8,6.5"
H,65,1.89,ddd,"12.4,2.7,0.7"
H,66,4.11,ddd,"6.9,6.5,0.7"
H,67,,,
H,68,4.24,ddd,"6.9,4.7,3.5"
H,69,,,
H,70,2.21,dd,"12.4,3.5"
H,71,2.21,dd,"12.4,4.7"
H,72,1.0,s,
H,73,1.0,s,
H,74,1.0,s,
H,75,0.9,ddd,"11.2,9.3,7.1"
H,76,1.46,m,
H,77,1.46,m,
H,78,1.73,ddd,"12.4,10.9,8.9"
H,79,1.73,ddd,"12.4,9.5,2.0"
H,80,0.69,s,
H,81,0.69,s,
H,82,0.69,s,
