C,1,18.87,s, C,2,40.4,s, C,3,122.7,s, N,4,,, C,5,159.58,s, O,6,,, C,7,157.99,s, C,8,49.9,s, S,9,,, C,10,38.15,s, O,11,,, N,12,,, C,13,145.66,s, C,14,132.07,s, C,15,143.15,s, C,16,23.8,s, C,17,34.66,s, C,18,,, O,19,,, C,20,41.86,s, C,21,173.63,s, O,22,,, N,23,,, C,24,32.02,s, C,25,142.35,s, C,26,116.11,s, C,27,131.17,s, C,28,122.44,s, C,29,124.58,s, C,30,134.28,s, H,31,1.03,d,6.8 H,32,1.03,d,6.8 H,33,1.03,d,6.8 H,34,2.83,q,6.8 H,35,,, H,36,3.37,s, H,37,3.37,s, H,38,2.59,s, H,39,2.59,s, H,40,2.59,s, H,41,2.37,ddd,"12.4,12.0,4.2" H,42,2.37,ddd,"12.4,11.7,7.0" H,43,2.67,ddd,"18.4,12.0,7.0" H,44,2.67,ddd,"18.4,11.7,4.2" H,45,3.72,s, H,46,3.72,s, H,47,3.72,s, H,48,7.32,ddd,"7.9,1.4,0.5" H,49,7.43,ddd,"7.9,7.0,1.4" H,50,6.94,ddd,"7.1,7.0,1.4" H,51,7.25,ddd,"7.1,1.4,0.5"