C,1,25.05,s,
C,2,71.8,s,
C,3,25.05,s,
O,4,,,
C,5,83.52,s,
C,6,30.57,s,
C,7,28.16,s,
C,8,41.92,s,
C,9,50.55,s,
C,10,27.7,s,
C,11,30.8,s,
C,12,51.8,s,
C,13,24.6,s,
C,14,136.4,s,
C,15,133.6,s,
C,16,21.1,s,
C,17,31.35,s,
C,18,43.7,s,
C,19,22.27,s,
C,20,37.8,s,
C,21,20.7,s,
C,22,42.6,s,
C,23,68.35,s,
O,24,,,
C,25,83.45,s,
O,26,,,
C,27,39.5,s,
C,28,23.0,s,
C,29,23.0,s,
C,30,51.7,s,
C,31,19.5,s,
C,32,26.5,s,
C,33,99.79,s,
O,34,,,
O,35,,,
H,36,1.3,s,
H,37,1.3,s,
H,38,1.3,s,
H,39,1.3,s,
H,40,1.3,s,
H,41,1.3,s,
H,42,,,
H,43,4.54,dd,"8.1,7.9"
H,44,1.8,m,
H,45,1.8,m,
H,46,1.58,m,
H,47,1.58,m,
H,48,1.7,m,
H,49,1.61,ddd,"10.9,5.9,5.7"
H,50,1.72,m,
H,51,1.72,m,
H,52,1.77,ddd,"12.4,9.9,9.6"
H,53,1.77,ddd,"12.4,10.3,1.9"
H,54,1.14,s,
H,55,1.14,s,
H,56,1.14,s,
H,57,2.1,ddd,"15.4,11.0,7.1"
H,58,2.1,ddd,"15.4,11.3,1.0"
H,59,1.96,ddd,"12.4,11.3,7.1"
H,60,1.96,ddd,"12.4,11.0,1.0"
H,61,1.02,s,
H,62,1.02,s,
H,63,1.02,s,
H,64,1.08,s,
H,65,1.08,s,
H,66,1.08,s,
H,67,3.3,dd,"12.4,6.4"
H,68,3.3,dd,"12.4,2.0"
H,69,4.21,ddd,"6.4,3.3,2.0"
H,70,,,
H,71,3.43,d,3.3
H,72,,,
H,73,1.16,s,
H,74,1.16,s,
H,75,1.16,s,
H,76,1.16,s,
H,77,1.16,s,
H,78,1.16,s,
H,79,0.92,dd,"11.4,2.0"
H,80,1.92,m,
H,81,1.92,m,
H,82,2.37,ddd,"15.4,14.1,5.6"
H,83,2.37,ddd,"15.4,4.4,2.3"
H,84,5.2,d,4.6
H,85,,,
