C,1,22.42,s, C,2,24.66,s, C,3,22.42,s, C,4,36.24,s, C,5,57.53,s, N,6,,, C,7,162.36,s, O,8,,, C,9,57.53,s, C,10,35.29,s, C,11,124.82,s, C,12,111.06,s, C,13,142.97,s, O,14,,, C,15,139.17,s, N,16,,, C,17,31.45,s, C,18,169.5,s, O,19,,, C,20,57.53,s, C,21,30.56,s, C,22,18.38,s, C,23,18.38,s, N,24,,, C,25,162.36,s, O,26,,, C,27,57.53,s, C,28,30.56,s, C,29,18.38,s, C,30,18.38,s, N,31,,, C,32,162.36,s, O,33,,, C,34,57.53,s, C,35,30.56,s, C,36,18.38,s, C,37,18.38,s, N,38,,, C,39,162.36,s, O,40,,, C,41,57.53,s, C,42,35.29,s, C,43,124.82,s, C,44,111.06,s, C,45,142.97,s, O,46,,, C,47,139.17,s, N,48,,, C,49,31.45,s, C,50,169.5,s, O,51,,, C,52,53.83,s, C,53,18.06,s, N,54,,, C,55,27.2,s, C,56,169.5,s, O,57,,, H,58,0.8,d,6.4 H,59,0.8,d,6.4 H,60,0.8,d,6.4 H,61,1.67,m,"6.4,5.9" H,62,0.8,d,6.4 H,63,0.8,d,6.4 H,64,0.8,d,6.4 H,65,1.87,dd,"6.1,5.9" H,66,1.87,dd,"6.1,5.9" H,67,3.58,t,6.1 H,68,,, H,69,4.28,t,6.6 H,70,3.01,d,6.6 H,71,3.01,d,6.6 H,72,6.28,dd,"3.0,1.9" H,73,7.35,d,3.0 H,74,7.23,d,1.9 H,75,2.91,s, H,76,2.91,s, H,77,2.91,s, H,78,5.02,d,5.3 H,79,2.09,m,"6.4,5.3" H,80,0.88,d,6.4 H,81,0.88,d,6.4 H,82,0.88,d,6.4 H,83,0.88,d,6.4 H,84,0.88,d,6.4 H,85,0.88,d,6.4 H,86,,, H,87,4.03,d,5.4 H,88,2.19,m,"6.4,5.4" H,89,0.82,d,6.4 H,90,0.82,d,6.4 H,91,0.82,d,6.4 H,92,0.82,d,6.4 H,93,0.82,d,6.4 H,94,0.82,d,6.4 H,95,,, H,96,4.03,d,5.4 H,97,2.19,m,"6.4,5.4" H,98,0.82,d,6.4 H,99,0.82,d,6.4 H,100,0.82,d,6.4 H,101,0.82,d,6.4 H,102,0.82,d,6.4 H,103,0.82,d,6.4 H,104,,, H,105,4.28,t,6.6 H,106,3.01,d,6.6 H,107,3.01,d,6.6 H,108,6.28,dd,"3.3,1.9" H,109,7.35,d,3.3 H,110,7.23,d,1.9 H,111,2.91,s, H,112,2.91,s, H,113,2.91,s, H,114,3.73,q,6.8 H,115,1.4,d,6.8 H,116,1.4,d,6.8 H,117,1.4,d,6.8 H,118,2.91,s, H,119,2.91,s, H,120,2.91,s,