C,1,21.01,s, C,2,169.84,s, O,3,,, O,4,,, C,5,79.25,s, C,6,76.9,s, O,7,,, C,8,169.89,s, C,9,20.79,s, O,10,,, C,11,41.86,s, C,12,23.79,s, C,13,80.12,s, C,14,120.49,s, C,15,109.66,s, C,16,142.98,s, O,17,,, C,18,141.04,s, O,19,,, C,20,166.95,s, O,21,,, C,22,56.8,s, O,23,,, C,24,77.48,s, C,25,48.25,s, C,26,12.21,s, C,27,76.9,s, O,28,,, C,29,169.89,s, C,30,20.79,s, O,31,,, C,32,79.25,s, O,33,,, C,34,169.84,s, C,35,21.01,s, O,36,,, C,37,47.92,s, C,38,81.82,s, C,39,25.61,s, C,40,25.61,s, O,41,,, C,42,167.5,s, O,43,,, C,44,122.7,s, C,45,144.6,s, C,46,41.86,s, C,47,23.79,s, C,48,51.51,s, H,49,2.03,s, H,50,2.03,s, H,51,2.03,s, H,52,5.21,dd,"10.5,10.3" H,53,4.77,d,10.5 H,54,2.0,s, H,55,2.0,s, H,56,2.0,s, H,57,1.13,s, H,58,1.13,s, H,59,1.13,s, H,60,6.02,s, H,61,6.44,dd,"2.6,1.9" H,62,7.43,d,2.6 H,63,7.54,d,1.9 H,64,3.88,s, H,65,1.46,s, H,66,1.46,s, H,67,1.46,s, H,68,4.77,d,6.2 H,69,2.0,s, H,70,2.0,s, H,71,2.0,s, H,72,4.66,dd,"6.2,2.6" H,73,2.03,s, H,74,2.03,s, H,75,2.03,s, H,76,3.07,d,2.6 H,77,1.34,s, H,78,1.34,s, H,79,1.34,s, H,80,1.34,s, H,81,1.34,s, H,82,1.34,s, H,83,6.26,d,12.0 H,84,6.3,d,12.0 H,85,1.13,s, H,86,1.13,s, H,87,1.13,s, H,88,2.9,d,10.3