C,1,111.24,s,
C,2,148.14,s,
C,3,19.56,s,
C,4,42.38,s,
C,5,35.12,s,
C,6,74.36,s,
O,7,,,
C,8,77.18,s,
C,9,22.95,s,
O,10,,,
C,11,46.29,s,
C,12,136.39,s,
C,13,132.53,s,
C,14,142.48,s,
C,15,15.52,s,
C,16,146.83,s,
C,17,,,
O,18,,,
C,19,36.6,s,
C,20,50.1,s,
C,21,45.28,s,
C,22,25.41,s,
C,23,39.6,s,
C,24,18.4,s,
C,25,46.7,s,
C,26,38.2,s,
C,27,22.42,s,
C,28,22.42,s,
C,29,80.87,s,
O,30,,,
C,31,170.83,s,
C,32,21.21,s,
O,33,,,
C,34,25.1,s,
C,35,33.0,s,
C,36,35.5,s,
C,37,23.3,s,
H,38,4.8,s,
H,39,4.8,s,
H,40,1.71,s,
H,41,1.71,s,
H,42,1.71,s,
H,43,2.99,ddd,"11.6,10.1,9.2"
H,44,1.88,ddd,"12.4,9.2,6.2"
H,45,1.88,ddd,"12.4,10.1,10.0"
H,46,4.08,dd,"10.0,6.2"
H,47,,,
H,48,1.39,s,
H,49,1.39,s,
H,50,1.39,s,
H,51,,,
H,52,3.27,dd,"11.6,7.0"
H,53,6.16,dd,"16.0,7.0"
H,54,6.9,d,16.0
H,55,2.17,s,
H,56,2.17,s,
H,57,2.17,s,
H,58,2.22,dd,"18.4,11.5"
H,59,2.22,dd,"18.4,9.9"
H,60,1.83,dd,"11.5,9.9"
H,61,1.42,s,
H,62,1.42,s,
H,63,1.42,s,
H,64,2.15,ddd,"12.4,10.8,5.7"
H,65,2.15,ddd,"12.4,11.5,2.6"
H,66,1.7,m,
H,67,1.7,m,
H,68,1.78,dd,"10.9,6.0"
H,69,0.88,s,
H,70,0.88,s,
H,71,0.88,s,
H,72,0.88,s,
H,73,0.88,s,
H,74,0.88,s,
H,75,4.47,dd,"5.9,1.9"
H,76,2.01,s,
H,77,2.01,s,
H,78,2.01,s,
H,79,1.73,m,
H,80,1.73,m,
H,81,1.6,ddd,"12.4,4.1,3.7"
H,82,1.6,ddd,"13.9,12.4,4.8"
H,83,1.01,s,
H,84,1.01,s,
H,85,1.01,s,
