C,1,22.07,s, C,2,24.86,s, C,3,22.07,s, C,4,41.25,s, C,5,48.78,s, N,6,,, C,7,171.0,s, O,8,,, C,9,57.25,s, C,10,30.64,s, C,11,18.58,s, C,12,18.58,s, N,13,,, C,14,172.4,s, O,15,,, C,16,54.9,s, N,17,,, C,18,153.2,s, O,19,,, N,20,,, C,21,54.73,s, C,22,35.89,s, C,23,136.58,s, C,24,131.13,s, C,25,132.5,s, C,26,132.5,s, C,27,132.5,s, C,28,132.49,s, C,29,174.85,s, O,30,,, O,31,,, C,32,31.7,s, C,33,20.5,s, C,34,28.3,s, C,35,38.5,s, N,36,,, C,37,171.9,s, O,38,,, C,39,59.23,s, C,40,30.69,s, C,41,50.29,s, S,42,,, C,43,37.89,s, O,44,,, N,45,,, C,46,33.32,s, C,47,171.67,s, O,48,,, C,49,59.23,s, C,50,29.71,s, C,51,25.47,s, C,52,136.58,s, C,53,131.13,s, C,54,111.82,s, C,55,178.29,s, O,56,,, C,57,124.74,s, C,58,132.49,s, N,59,,, C,60,33.32,s, C,61,171.65,s, O,62,,, H,63,0.92,d,6.4 H,64,0.92,d,6.4 H,65,0.92,d,6.4 H,66,1.73,m,"6.4,5.9" H,67,0.92,d,6.4 H,68,0.92,d,6.4 H,69,0.92,d,6.4 H,70,1.58,dd,"6.2,5.9" H,71,1.58,dd,"6.2,5.9" H,72,1.59,t,6.2 H,73,,, H,74,4.42,d,5.5 H,75,1.44,m,"6.4,5.5" H,76,0.97,d,6.4 H,77,0.97,d,6.4 H,78,0.97,d,6.4 H,79,0.98,d,6.4 H,80,0.98,d,6.4 H,81,0.98,d,6.4 H,82,,, H,83,4.37,dd,"5.6,1.8" H,84,,, H,85,,, H,86,3.85,t,6.3 H,87,2.17,d,6.3 H,88,2.17,d,6.3 H,89,7.28,m, H,90,7.28,m, H,91,7.28,ddt,"7.4,7.1,1.4" H,92,7.28,m, H,93,7.28,m, H,94,,, H,95,2.0,m, H,96,1.59,m, H,97,1.47,m, H,98,1.47,m, H,99,1.62,m, H,100,2.0,m, H,101,3.2,ddd,"12.4,5.8,3.5" H,102,3.78,ddd,"12.4,10.7,3.3" H,103,,, H,104,3.89,t,6.4 H,105,2.52,td,"6.6,6.4" H,106,2.52,td,"6.6,6.4" H,107,3.2,dt,"12.4,6.6" H,108,3.0,dt,"12.4,6.6" H,109,2.86,s, H,110,2.86,s, H,111,2.86,s, H,112,3.03,s, H,113,3.03,s, H,114,3.03,s, H,115,3.89,t,6.4 H,116,1.59,td,"6.8,6.4" H,117,1.59,td,"6.8,6.4" H,118,2.64,t,6.8 H,119,2.64,t,6.8 H,120,7.19,ddd,"6.7,1.9,0.5" H,121,6.9,ddd,"6.7,1.9,0.5" H,122,,, H,123,6.88,ddd,"7.4,1.9,0.5" H,124,7.28,ddd,"7.4,1.9,0.5" H,125,3.03,s, H,126,3.03,s, H,127,3.03,s,