C,1,18.52,s,
C,2,35.16,s,
C,3,35.12,s,
C,4,76.51,s,
O,5,,,
C,6,109.5,s,
O,7,,,
C,8,78.54,s,
C,9,72.42,s,
C,10,25.27,s,
C,11,25.27,s,
O,12,,,
C,13,73.63,s,
O,14,,,
C,15,41.86,s,
C,16,23.79,s,
C,17,169.39,s,
C,18,126.29,s,
C,19,31.12,s,
C,20,49.45,s,
C,21,39.26,s,
C,22,22.07,s,
C,23,22.07,s,
C,24,89.1,s,
O,25,,,
C,26,107.46,s,
O,27,,,
C,28,66.98,s,
C,29,70.91,s,
O,30,,,
C,31,77.76,s,
O,32,,,
C,33,74.92,s,
O,34,,,
C,35,29.85,s,
C,36,31.96,s,
C,37,23.43,s,
C,38,23.48,s,
C,39,41.86,s,
C,40,35.28,s,
C,41,32.64,s,
C,42,43.99,s,
C,43,17.82,s,
C,44,50.05,s,
H,45,0.92,d,6.5
H,46,0.92,d,6.5
H,47,0.92,d,6.5
H,48,1.68,m,
H,49,1.88,dd,"12.4,5.6"
H,50,1.88,ddd,"12.4,10.1,9.0"
H,51,4.61,dd,"9.0,4.8"
H,52,4.76,d,4.8
H,53,1.33,s,
H,54,1.33,s,
H,55,1.33,s,
H,56,1.33,s,
H,57,1.33,s,
H,58,1.33,s,
H,59,,,
H,60,4.52,s,
H,61,,,
H,62,1.87,s,
H,63,1.87,s,
H,64,1.87,s,
H,65,5.54,dd,"5.7,2.6"
H,66,2.25,ddd,"15.4,8.1,2.6"
H,67,2.25,ddd,"15.4,5.7,1.1"
H,68,1.33,dd,"8.1,1.1"
H,69,1.07,s,
H,70,1.07,s,
H,71,1.07,s,
H,72,1.07,s,
H,73,1.07,s,
H,74,1.07,s,
H,75,3.4,dd,"11.8,5.4"
H,76,4.78,d,7.6
H,77,4.14,dd,"11.0,9.4"
H,78,4.14,dd,"9.4,3.4"
H,79,4.09,ddd,"11.0,9.5,3.4"
H,80,,,
H,81,4.04,dd,"9.5,8.3"
H,82,,,
H,83,3.92,dd,"8.3,7.6"
H,84,,,
H,85,2.2,m,
H,86,2.2,m,
H,87,1.48,ddd,"13.4,12.4,3.6"
H,88,1.48,ddd,"12.4,3.9,2.0"
H,89,1.75,s,
H,90,1.75,s,
H,91,1.72,ddd,"12.4,10.4,8.0"
H,92,1.72,ddd,"12.4,11.2,1.0"
H,93,2.01,ddd,"12.4,11.2,8.0"
H,94,2.01,ddd,"12.4,10.4,1.0"
H,95,1.02,s,
H,96,1.02,s,
H,97,1.02,s,
H,98,3.22,d,7.6
