C,1,13.1,s, C,2,122.0,s, C,3,137.53,s, C,4,14.8,s, C,5,67.25,s, O,6,,, C,7,75.28,s, O,8,,, C,9,57.52,s, C,10,75.28,s, O,11,,, C,12,74.33,s, O,13,,, C,14,35.64,s, C,15,15.25,s, C,16,33.23,s, C,17,27.1,s, C,18,24.74,s, C,19,30.55,s, C,20,60.94,s, O,21,,, C,22,64.49,s, C,23,17.2,s, C,24,46.29,s, C,25,119.6,s, C,26,138.0,s, C,27,37.7,s, C,28,39.9,s, C,29,33.1,s, C,30,22.2,s, C,31,38.6,s, C,32,36.7,s, C,33,21.8,s, C,34,39.6,s, C,35,39.3,s, C,36,193.1,s, O,37,,, C,38,105.45,s, C,39,194.35,s, O,40,,, C,41,49.05,s, N,42,,, O,43,,, C,44,168.9,s, O,45,,, H,46,1.92,d,7.0 H,47,1.92,d,7.0 H,48,1.92,d,7.0 H,49,5.37,qdq,"7.0,1.9,0.4" H,50,1.75,d,0.4 H,51,1.75,d,0.4 H,52,1.75,d,0.4 H,53,3.84,dd,"5.0,1.9" H,54,,, H,55,3.7,t,5.0 H,56,,, H,57,3.85,dd,"5.0,3.2" H,58,3.89,dd,"3.2,1.9" H,59,,, H,60,3.89,dd,"10.3,1.9" H,61,,, H,62,1.44,m, H,63,0.97,d,6.5 H,64,0.97,d,6.5 H,65,0.97,d,6.5 H,66,1.31,m, H,67,1.87,m, H,68,2.0,m, H,69,1.27,m, H,70,1.31,m, H,71,1.31,m, H,72,2.17,m, H,73,2.86,m, H,74,3.49,dd,"8.9,6.9" H,75,1.3,s, H,76,1.3,s, H,77,1.3,s, H,78,2.17,ddd,"12.5,2.8,2.3" H,79,7.36,ddd,"8.8,2.8,2.1" H,80,6.65,ddd,"8.8,3.7,2.3" H,81,1.83,m, H,82,1.87,ddd,"13.0,12.4,11.5" H,83,1.87,ddd,"12.4,4.1,2.4" H,84,2.17,m, H,85,0.97,d,6.4 H,86,0.97,d,6.4 H,87,0.97,d,6.4 H,88,1.87,ddd,"12.4,2.5,2.2" H,89,1.27,ddd,"12.5,12.4,10.6" H,90,2.17,m, H,91,0.97,d,6.5 H,92,0.97,d,6.5 H,93,0.97,d,6.5 H,94,2.17,ddd,"9.7,5.8,4.4" H,95,1.83,dd,"12.5,9.7" H,96,,, H,97,4.05,d,15.4 H,98,3.85,d,15.4