C,1,18.58,s, C,2,30.25,s, C,3,18.58,s, C,4,58.42,s, N,5,,, C,6,171.56,s, O,7,,, C,8,59.23,s, C,9,35.89,s, C,10,136.58,s, C,11,131.13,s, C,12,132.5,s, C,13,132.5,s, C,14,132.5,s, C,15,132.49,s, N,16,,, C,17,33.32,s, C,18,172.7,s, O,19,,, C,20,53.07,s, C,21,33.64,s, C,22,18.49,s, C,23,18.49,s, N,24,,, C,25,168.45,s, O,26,,, C,27,62.56,s, C,28,26.59,s, C,29,18.86,s, C,30,18.86,s, N,31,,, C,32,30.17,s, C,33,171.45,s, O,34,,, C,35,53.23,s, C,36,35.89,s, C,37,136.58,s, C,38,131.13,s, C,39,132.5,s, C,40,132.5,s, C,41,132.5,s, C,42,132.49,s, N,43,,, C,44,171.0,s, O,45,,, H,46,0.89,d,6.4 H,47,0.89,d,6.4 H,48,0.89,d,6.4 H,49,2.93,m,"6.4,5.5" H,50,1.0,d,6.4 H,51,1.0,d,6.4 H,52,1.0,d,6.4 H,53,3.9,d,5.5 H,54,,, H,55,3.89,t,6.5 H,56,3.05,dd,"13.4,6.5" H,57,3.25,dd,"13.4,6.5" H,58,7.38,m, H,59,7.28,m, H,60,7.28,ddt,"7.8,6.9,1.4" H,61,7.28,m, H,62,7.38,m, H,63,3.03,s, H,64,3.03,s, H,65,3.03,s, H,66,3.85,d,5.5 H,67,1.44,m,"6.4,5.5" H,68,0.97,d,6.4 H,69,0.97,d,6.4 H,70,0.97,d,6.4 H,71,0.97,d,6.4 H,72,0.97,d,6.4 H,73,0.97,d,6.4 H,74,,, H,75,3.85,d,5.7 H,76,1.44,m,"6.4,5.7" H,77,0.97,d,6.4 H,78,0.97,d,6.4 H,79,0.97,d,6.4 H,80,0.97,d,6.4 H,81,0.97,d,6.4 H,82,0.97,d,6.4 H,83,2.86,s, H,84,2.86,s, H,85,2.86,s, H,86,3.89,t,6.3 H,87,2.94,dd,"13.4,6.3" H,88,3.25,dd,"13.4,6.3" H,89,7.28,m, H,90,7.28,m, H,91,7.28,ddt,"7.3,6.8,1.4" H,92,7.28,m, H,93,7.28,m, H,94,,,