C,1,22.9,s,
C,2,29.1,s,
C,3,22.9,s,
C,4,40.7,s,
C,5,24.4,s,
C,6,30.8,s,
C,7,41.4,s,
C,8,71.36,s,
O,9,,,
S,10,,,
O,11,,,
O,12,,,
O,13,,,
C,14,51.9,s,
C,15,28.6,s,
C,16,25.1,s,
C,17,57.4,s,
C,18,36.72,s,
C,19,28.71,s,
C,20,28.59,s,
C,21,42.85,s,
C,22,35.12,s,
C,23,73.63,s,
O,24,,,
S,25,,,
O,26,,,
O,27,,,
O,28,,,
C,29,30.57,s,
C,30,35.27,s,
C,31,35.76,s,
C,32,18.22,s,
C,33,43.66,s,
C,34,21.91,s,
C,35,40.98,s,
C,36,43.5,s,
C,37,12.7,s,
H,38,0.79,d,6.4
H,39,0.79,d,6.4
H,40,0.79,d,6.4
H,41,1.52,m,"6.4,5.9"
H,42,0.79,d,6.4
H,43,0.79,d,6.4
H,44,0.79,d,6.4
H,45,1.18,td,"6.6,5.9"
H,46,1.18,td,"6.6,5.9"
H,47,1.37,m,6.6
H,48,1.37,m,6.6
H,49,1.58,td,"6.6,6.1"
H,50,1.58,td,"6.6,6.1"
H,51,2.3,ttd,"6.1,5.8,5.6"
H,52,4.28,d,5.8
H,53,4.28,d,5.8
H,54,,,
H,55,1.61,ddd,"10.9,5.6,3.3"
H,56,1.48,m,
H,57,1.48,m,
H,58,1.32,m,
H,59,1.32,m,
H,60,1.02,ddd,"11.9,10.6,4.6"
H,61,1.86,m,
H,62,1.58,m,
H,63,1.58,m,
H,64,1.47,m,
H,65,1.47,m,
H,66,1.09,ddt,"12.1,12.0,5.4"
H,67,1.88,ddd,"12.4,5.4,1.5"
H,68,1.88,ddd,"12.4,12.0,7.4"
H,69,4.49,ddt,"7.4,6.8,1.5"
H,70,,,
H,71,2.74,m,
H,72,2.74,m,
H,73,1.5,ddd,"12.4,5.5,2.6"
H,74,1.5,ddd,"13.2,12.4,4.3"
H,75,0.93,s,
H,76,0.93,s,
H,77,0.93,s,
H,78,0.83,ddd,"11.3,10.9,6.5"
H,79,1.46,m,
H,80,1.46,m,
H,81,1.73,ddd,"12.4,7.2,2.0"
H,82,1.73,ddd,"12.4,12.0,6.7"
H,83,0.69,s,
H,84,0.69,s,
H,85,0.69,s,
