C,1,21.6,s, C,2,126.2,s, C,3,137.4,s, C,4,125.8,s, C,5,138.4,s, C,6,137.16,s, C,7,12.4,s, C,8,130.98,s, C,9,126.01,s, C,10,138.44,s, C,11,137.13,s, C,12,12.82,s, C,13,134.44,s, C,14,130.98,s, C,15,130.98,s, C,16,134.44,s, C,17,137.13,s, C,18,12.82,s, C,19,138.44,s, C,20,125.36,s, C,21,132.57,s, C,22,137.1,s, C,23,12.88,s, C,24,128.32,s, C,25,135.73,s, C,26,69.6,s, O,27,,, C,28,65.65,s, C,29,20.54,s, C,30,35.22,s, C,31,24.84,s, C,32,35.97,s, C,33,38.92,s, C,34,24.95,s, C,35,24.95,s, C,36,37.1,s, C,37,29.5,s, C,38,29.5,s, C,39,48.4,s, C,40,65.1,s, O,41,,, C,42,42.6,s, H,43,1.74,s, H,44,1.74,s, H,45,1.74,s, H,46,6.14,s, H,47,6.16,s, H,48,1.97,s, H,49,1.97,s, H,50,1.97,s, H,51,6.18,d,11.0 H,52,6.66,dd,"17.0,11.0" H,53,6.41,d,17.0 H,54,2.0,s, H,55,2.0,s, H,56,2.0,s, H,57,6.31,d,11.0 H,58,6.68,dd,"17.0,11.0" H,59,6.68,dd,"17.0,11.0" H,60,6.31,d,11.0 H,61,2.0,s, H,62,2.0,s, H,63,2.0,s, H,64,6.41,d,17.0 H,65,6.66,dd,"17.0,11.0" H,66,6.27,d,11.0 H,67,1.99,s, H,68,1.99,s, H,69,1.99,s, H,70,6.99,d,16.0 H,71,7.64,d,16.0 H,72,1.27,s, H,73,1.27,s, H,74,1.27,s, H,75,1.9,ddd,"12.4,5.6,3.0" H,76,1.9,ddd,"12.4,11.5,6.7" H,77,1.42,m, H,78,1.42,m, H,79,1.71,ddd,"12.4,10.9,1.8" H,80,1.71,ddd,"12.4,11.1,7.6" H,81,1.08,s, H,82,1.08,s, H,83,1.08,s, H,84,1.08,s, H,85,1.08,s, H,86,1.08,s, H,87,1.08,s, H,88,1.08,s, H,89,1.08,s, H,90,1.08,s, H,91,1.08,s, H,92,1.08,s, H,93,1.77,dd,"12.4,3.6" H,94,1.77,dd,"12.4,10.8" H,95,3.99,m, H,96,,, H,97,2.38,dd,"15.4,9.0" H,98,2.38,dd,"15.4,6.6"