C,1,15.61,s,
C,2,139.01,s,
C,3,127.36,s,
C,4,18.81,s,
C,5,167.45,s,
O,6,,,
O,7,,,
C,8,78.41,s,
C,9,38.62,s,
C,10,78.41,s,
O,11,,,
C,12,170.18,s,
C,13,21.24,s,
O,14,,,
C,15,41.86,s,
C,16,72.44,s,
O,17,,,
C,18,108.63,s,
O,19,,,
C,20,49.86,s,
C,21,168.54,s,
O,22,,,
O,23,,,
C,24,52.65,s,
C,25,40.4,s,
C,26,48.25,s,
C,27,12.21,s,
C,28,76.9,s,
O,29,,,
C,30,77.48,s,
C,31,25.81,s,
C,32,51.64,s,
C,33,35.12,s,
C,34,83.52,s,
O,35,,,
C,36,99.28,s,
O,37,,,
C,38,150.18,s,
C,39,106.2,s,
C,40,77.48,s,
O,41,,,
C,42,170.11,s,
C,43,21.54,s,
O,44,,,
C,45,81.29,s,
O,46,,,
C,47,79.25,s,
O,48,,,
C,49,72.44,s,
C,50,42.73,s,
C,51,20.29,s,
C,52,40.4,s,
H,53,1.9,d,7.0
H,54,1.9,d,7.0
H,55,1.9,d,7.0
H,56,6.46,q,7.0
H,57,1.87,s,
H,58,1.87,s,
H,59,1.87,s,
H,60,4.68,dd,"11.5,3.4"
H,61,2.13,ddd,"12.4,11.9,11.5"
H,62,2.13,ddd,"12.4,6.0,3.4"
H,63,4.77,dd,"11.9,6.0"
H,64,2.01,s,
H,65,2.01,s,
H,66,2.01,s,
H,67,4.13,s,
H,68,4.13,s,
H,69,3.32,s,
H,70,3.32,s,
H,71,3.32,s,
H,72,3.74,s,
H,73,3.74,s,
H,74,3.74,s,
H,75,3.46,s,
H,76,1.6,s,
H,77,1.6,s,
H,78,1.6,s,
H,79,4.77,d,9.4
H,80,1.52,s,
H,81,1.52,s,
H,82,1.52,s,
H,83,2.52,dd,"6.4,1.3"
H,84,1.89,ddd,"12.4,2.9,1.3"
H,85,1.89,ddd,"12.4,6.4,1.8"
H,86,4.18,dd,"2.9,1.8"
H,87,5.98,s,
H,88,6.5,d,4.8
H,89,5.63,d,4.8
H,90,2.14,s,
H,91,2.14,s,
H,92,2.14,s,
H,93,,,
H,94,4.66,dd,"10.3,9.4"
H,95,3.55,s,
H,96,3.55,s,
H,97,1.17,s,
H,98,1.17,s,
H,99,1.17,s,
H,100,2.47,d,10.3
