C,1,25.38,s, C,2,83.3,s, C,3,25.38,s, O,4,,, C,5,67.4,s, C,6,75.11,s, O,7,,, C,8,99.8,s, O,9,,, C,10,99.8,s, O,11,,, C,12,75.22,s, C,13,62.29,s, O,14,,, C,15,70.63,s, O,16,,, C,17,75.25,s, O,18,,, C,19,73.18,s, O,20,,, C,21,73.18,s, O,22,,, C,23,77.96,s, O,24,,, C,25,71.37,s, O,26,,, C,27,57.53,s, N,28,,, C,29,174.5,s, O,30,,, O,31,,, H,32,1.42,s, H,33,1.42,s, H,34,1.42,s, H,35,1.42,s, H,36,1.42,s, H,37,1.42,s, H,38,3.41,d,5.3 H,39,3.41,d,5.3 H,40,3.72,dt,"6.7,5.3" H,41,4.67,d,3.5 H,42,4.67,d,5.5 H,43,3.26,dt,"9.2,5.4" H,44,4.04,d,5.4 H,45,4.04,d,5.4 H,46,,, H,47,3.99,dd,"9.2,1.4" H,48,,, H,49,3.32,dd,"7.5,1.4" H,50,,, H,51,3.23,dd,"7.5,5.5" H,52,,, H,53,3.23,dd,"4.3,3.5" H,54,,, H,55,3.69,dd,"10.1,4.3" H,56,,, H,57,3.32,dd,"10.1,6.7" H,58,,, H,59,4.28,s, H,60,,, H,61,,, H,62,,,