C,1,22.12,s, C,2,24.52,s, C,3,22.12,s, C,4,38.98,s, C,5,76.12,s, O,6,,, C,7,172.04,s, O,8,,, C,9,34.1,s, C,10,35.25,s, N,11,,, C,12,171.9,s, O,13,,, C,14,62.43,s, C,15,37.57,s, C,16,25.4,s, C,17,22.48,s, C,18,22.48,s, N,19,,, C,20,33.32,s, C,21,169.8,s, O,22,,, C,23,57.6,s, C,24,26.86,s, C,25,18.39,s, C,26,18.39,s, N,27,,, C,28,30.17,s, C,29,171.45,s, O,30,,, C,31,53.23,s, C,32,35.89,s, C,33,136.58,s, C,34,131.13,s, C,35,132.5,s, C,36,132.5,s, C,37,132.5,s, C,38,132.49,s, N,39,,, C,40,173.33,s, O,41,,, C,42,60.27,s, C,43,28.9,s, C,44,23.93,s, C,45,47.3,s, N,46,,, C,47,171.19,s, O,48,,, H,49,0.92,d,6.4 H,50,0.92,d,6.4 H,51,0.92,d,6.4 H,52,1.77,m,"6.4,5.9" H,53,0.92,d,6.4 H,54,0.92,d,6.4 H,55,0.92,d,6.4 H,56,1.59,ddd,"12.4,6.0,5.9" H,57,1.58,ddd,"12.4,6.0,5.9" H,58,4.12,t,6.0 H,59,2.96,ddd,"15.4,13.4,2.0" H,60,2.43,ddd,"15.4,13.3,8.0" H,61,3.45,ddd,"13.4,12.4,8.0" H,62,3.45,ddd,"13.3,12.4,2.0" H,63,,, H,64,3.85,t,6.4 H,65,2.52,ddd,"12.4,6.4,5.9" H,66,1.84,ddd,"12.4,6.4,5.9" H,67,1.44,m,"6.4,5.9" H,68,0.92,td,"12.4,6.4" H,69,0.88,dd,"12.4,6.4" H,70,0.88,dd,"12.4,6.4" H,71,0.92,d,6.4 H,72,0.92,d,6.4 H,73,0.92,d,6.4 H,74,2.86,s, H,75,2.86,s, H,76,2.86,s, H,77,3.85,d,5.7 H,78,1.44,m,"6.4,5.7" 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,83,0.97,d,6.4 H,84,0.97,d,6.4 H,85,2.86,s, H,86,2.86,s, H,87,2.86,s, H,88,3.74,t,6.3 H,89,2.17,dd,"13.4,6.3" H,90,2.86,dd,"13.4,6.3" H,91,7.28,m, H,92,7.28,m, H,93,7.36,ddt,"8.6,6.7,1.4" H,94,7.28,m, H,95,7.36,m, H,96,,, H,97,3.89,dd,"5.5,1.3" H,98,1.68,m, H,99,1.68,m, H,100,1.64,m, H,101,1.64,m, H,102,3.47,ddd,"12.4,10.8,2.1" H,103,3.47,ddd,"12.4,11.3,6.2"