C,1,21.36,s, C,2,130.09,s, C,3,137.53,s, C,4,127.38,s, C,5,137.3,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,20,126.01,s, C,21,130.98,s, C,22,137.16,s, C,23,12.4,s, C,24,138.4,s, C,25,125.8,s, C,26,137.4,s, C,27,126.2,s, C,28,21.6,s, C,29,42.6,s, C,30,65.1,s, O,31,,, C,32,48.4,s, C,33,37.1,s, C,34,29.5,s, C,35,29.5,s, C,36,33.93,s, C,37,28.68,s, C,38,28.68,s, C,39,39.33,s, C,40,18.7,s, C,41,32.75,s, H,42,1.7,s, H,43,1.7,s, H,44,1.7,s, H,45,6.18,d,13.0 H,46,6.16,d,13.0 H,47,1.97,s, H,48,1.97,s, H,49,1.97,s, H,50,6.18,d,11.0 H,51,6.66,dd,"13.0,11.0" H,52,6.41,d,13.0 H,53,2.0,s, H,54,2.0,s, H,55,2.0,s, H,56,6.31,d,11.0 H,57,6.68,dd,"13.0,11.0" H,58,6.68,dd,"13.0,11.0" H,59,6.31,d,11.0 H,60,2.0,s, H,61,2.0,s, H,62,2.0,s, H,63,6.41,d,13.0 H,64,6.66,dd,"13.0,11.0" H,65,6.18,d,11.0 H,66,1.97,s, H,67,1.97,s, H,68,1.97,s, H,69,6.16,d,17.0 H,70,6.14,d,17.0 H,71,1.74,s, H,72,1.74,s, H,73,1.74,s, H,74,2.38,dd,"15.4,8.0" H,75,2.38,dd,"15.4,8.4" H,76,3.99,m, H,77,,, H,78,1.77,dd,"12.4,5.2" H,79,1.77,dd,"12.4,10.4" H,80,1.08,s, 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,86,1.04,s, H,87,1.04,s, H,88,1.04,s, H,89,1.04,s, H,90,1.04,s, H,91,1.04,s, H,92,1.48,ddd,"12.4,9.4,8.2" H,93,1.48,ddd,"12.4,9.3,1.2" H,94,1.63,m, H,95,1.63,m, H,96,2.04,ddd,"15.4,10.6,0.6" H,97,2.04,ddd,"15.4,9.6,8.1"