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,19,139.93,s, C,20,128.43,s, C,21,124.49,s, C,22,137.59,s, C,23,17.63,s, C,24,36.73,s, C,25,26.48,s, C,26,137.27,s, C,27,125.4,s, C,28,20.2,s, C,29,40.5,s, C,30,65.8,s, O,31,,, C,32,49.8,s, C,33,40.0,s, C,34,29.7,s, C,35,29.7,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,17.0 H,46,6.16,d,17.0 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,"17.0,11.0" H,52,6.41,d,17.0 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,"17.0,11.0" H,58,6.68,dd,"17.0,11.0" H,59,6.31,d,11.0 H,60,2.0,s, H,61,2.0,s, H,62,2.0,s, H,63,6.43,d,17.0 H,64,6.42,dd,"17.0,11.0" H,65,5.82,d,11.0 H,66,1.71,s, H,67,1.71,s, H,68,1.71,s, H,69,2.17,t,7.0 H,70,2.17,t,7.0 H,71,1.65,t,7.0 H,72,1.65,t,7.0 H,73,1.88,s, H,74,1.88,s, H,75,1.88,s, H,76,2.38,dd,"15.4,1.3" H,77,2.38,dd,"15.4,8.8" H,78,3.99,m, H,79,,, H,80,1.77,dd,"12.4,7.3" H,81,1.77,dd,"12.4,8.5" H,82,1.3,s, H,83,1.3,s, H,84,1.3,s, H,85,1.3,s, H,86,1.3,s, H,87,1.3,s, H,88,1.04,s, H,89,1.04,s, H,90,1.04,s, H,91,1.04,s, H,92,1.04,s, H,93,1.04,s, H,94,1.48,ddd,"13.4,12.4,4.7" H,95,1.48,ddd,"12.4,3.5,3.1" H,96,1.63,m, H,97,1.63,m, H,98,2.04,ddd,"15.4,13.4,3.8" H,99,2.04,ddd,"15.4,5.3,2.5"