C,1,56.0,s, O,2,,, C,3,148.26,s, C,4,111.52,s, C,5,127.47,s, C,6,142.78,s, C,7,109.92,s, C,8,147.63,s, O,9,,, C,10,56.17,s, C,11,40.4,s, C,12,74.22,s, O,13,,, C,14,77.02,s, O,15,,, C,16,57.81,s, C,17,75.09,s, O,18,,, C,19,169.92,s, C,20,20.98,s, O,21,,, C,22,132.07,s, C,23,118.37,s, C,24,75.83,s, N,25,,, O,26,,, C,27,73.05,s, C,28,71.6,s, H,29,3.8,s, H,30,3.8,s, H,31,3.8,s, H,32,6.94,d,0.5 H,33,6.62,d,0.5 H,34,3.8,s, H,35,3.8,s, H,36,3.8,s, H,37,2.83,dd,"11.5,1.0" H,38,4.19,dd,"3.6,1.0" H,39,,, H,40,5.09,dd,"3.6,1.4" H,41,3.26,s, H,42,3.26,s, H,43,3.26,s, H,44,5.35,d,1.4 H,45,2.05,s, H,46,2.05,s, H,47,2.05,s, H,48,6.44,dd,"5.5,2.7" H,49,4.28,dd,"9.4,5.5" H,50,4.28,dd,"9.4,2.7" H,51,4.28,s, H,52,4.28,s, H,53,4.86,d,11.5