C,1,22.07,s, C,2,24.34,s, C,3,22.07,s, C,4,40.36,s, C,5,48.78,s, N,6,,, C,7,171.43,s, O,8,,, C,9,68.81,s, O,10,,, C,11,39.37,s, C,12,136.58,s, C,13,131.13,s, C,14,111.82,s, C,15,178.29,s, O,16,,, C,17,124.74,s, C,18,132.49,s, C,19,169.49,s, O,20,,, N,21,,, C,22,59.23,s, C,23,171.9,s, O,24,,, N,25,,, C,26,41.3,s, C,27,27.2,s, C,28,25.5,s, C,29,40.9,s, N,30,,, C,31,157.48,s, N,32,,, N,33,,, C,34,36.26,s, C,35,38.61,s, C,36,35.11,s, C,37,70.56,s, O,38,,, C,39,76.4,s, O,40,,, C,41,104.46,s, O,42,,, C,43,77.65,s, C,44,62.45,s, O,45,,, C,46,70.6,s, O,47,,, C,48,77.49,s, O,49,,, C,50,74.01,s, O,51,,, C,52,28.2,s, C,53,62.12,s, H,54,0.92,d,6.4 H,55,0.92,d,6.4 H,56,0.92,d,6.4 H,57,1.73,m,"6.4,5.9" H,58,0.92,d,6.4 H,59,0.92,d,6.4 H,60,0.92,d,6.4 H,61,2.52,ddd,"12.4,6.2,5.9" H,62,1.58,ddd,"12.4,6.2,5.9" H,63,4.56,t,6.2 H,64,,, H,65,4.12,t,6.0 H,66,,, H,67,3.18,d,6.0 H,68,3.18,d,6.0 H,69,7.19,ddd,"9.0,1.9,0.5" H,70,6.9,ddd,"9.0,1.9,0.5" H,71,,, H,72,6.9,ddd,"8.0,1.9,0.5" H,73,7.19,ddd,"8.0,1.9,0.5" H,74,3.89,dd,"5.8,1.3" H,75,,, H,76,3.2,t,6.5 H,77,3.2,t,6.5 H,78,1.64,dtt,"12.4,6.6,6.5" H,79,1.62,dtt,"12.4,6.6,6.5" H,80,1.64,tt,"6.6,6.4" H,81,1.64,tt,"6.6,6.4" H,82,3.2,t,6.4 H,83,3.2,t,6.4 H,84,,, H,85,,, H,86,,, H,87,,, H,88,2.0,ddd,"12.4,11.4,5.8" H,89,1.59,ddd,"12.4,8.3,1.3" H,90,1.83,m, H,91,2.86,ddd,"12.4,9.9,4.0" H,92,1.59,ddd,"12.4,7.7,1.7" H,93,3.49,ddd,"4.0,1.7,1.6" H,94,,, H,95,2.86,ddd,"8.7,8.2,1.6" H,96,3.85,d,3.4 H,97,4.12,dt,"9.2,5.4" H,98,3.73,dd,"11.4,5.4" H,99,3.75,dd,"11.4,5.4" H,100,,, H,101,3.49,dd,"9.8,9.2" H,102,,, H,103,3.49,dd,"9.8,5.3" H,104,,, H,105,3.63,dd,"5.3,3.4" H,106,,, H,107,1.59,ddd,"12.4,10.4,8.7" H,108,1.59,ddd,"12.4,8.2,6.0" H,109,4.42,ddd,"10.4,8.1,6.0"