C,1,20.71,s, C,2,170.51,s, O,3,,, O,4,,, C,5,71.31,s, C,6,77.48,s, O,7,,, C,8,156.9,s, C,9,111.97,s, C,10,127.4,s, C,11,125.61,s, C,12,125.61,s, C,13,127.4,s, C,14,111.97,s, C,15,156.9,s, C,16,105.96,s, C,17,156.32,s, O,18,,, C,19,178.7,s, O,20,,, C,21,109.05,s, C,22,187.0,s, O,23,,, C,24,34.3,s, C,25,35.66,s, C,26,15.22,s, C,27,76.78,s, O,28,,, C,29,170.41,s, C,30,20.44,s, O,31,,, C,32,77.48,s, C,33,66.19,s, O,34,,, O,35,,, C,36,156.32,s, O,37,,, C,38,105.96,s, C,39,178.7,s, O,40,,, C,41,109.05,s, C,42,187.0,s, O,43,,, C,44,34.3,s, C,45,35.66,s, C,46,15.22,s, C,47,76.78,s, O,48,,, C,49,170.41,s, C,50,20.44,s, O,51,,, H,52,1.87,s, H,53,1.87,s, H,54,1.87,s, H,55,4.31,s, H,56,4.31,s, H,57,7.0,d,6.7 H,58,7.56,dd,"6.7,0.5" H,59,7.56,dd,"9.1,0.5" H,60,7.0,d,9.1 H,61,,, H,62,,, H,63,2.61,dd,"15.4,1.9" H,64,2.61,dd,"15.4,6.2" H,65,2.08,m, H,66,1.0,d,6.5 H,67,1.0,d,6.5 H,68,1.0,d,6.5 H,69,5.28,d,5.9 H,70,2.09,s, H,71,2.09,s, H,72,2.09,s, H,73,3.92,s, H,74,3.92,s, H,75,,, H,76,,, H,77,,, H,78,2.61,dd,"15.4,10.1" H,79,2.61,dd,"15.4,7.9" H,80,2.08,m, H,81,1.0,d,6.5 H,82,1.0,d,6.5 H,83,1.0,d,6.5 H,84,5.28,d,7.5 H,85,2.09,s, H,86,2.09,s, H,87,2.09,s,