C,1,21.04,s, C,2,170.09,s, O,3,,, O,4,,, C,5,82.0,s, C,6,63.83,s, N,7,,, C,8,31.45,s, C,9,164.56,s, O,10,,, C,11,132.07,s, C,12,131.07,s, C,13,132.45,s, C,14,132.45,s, C,15,132.45,s, C,16,132.53,s, C,17,29.71,s, C,18,35.28,s, C,19,36.6,s, C,20,14.8,s, C,21,56.7,s, C,22,21.22,s, C,23,41.6,s, C,24,37.67,s, C,25,16.8,s, C,26,59.7,s, C,27,55.31,s, C,28,15.47,s, N,29,,, C,30,40.0,s, C,31,40.0,s, C,32,71.11,s, O,33,,, C,34,43.0,s, C,35,56.34,s, C,36,35.23,s, C,37,31.1,s, C,38,25.97,s, C,39,49.79,s, H,40,2.13,s, H,41,2.13,s, H,42,2.13,s, H,43,3.89,dd,"5.0,4.6" H,44,4.05,ddd,"9.7,7.9,4.6" H,45,3.03,s, H,46,3.03,s, H,47,3.03,s, H,48,7.43,m, H,49,7.28,m, H,50,7.28,ddt,"7.5,7.3,1.4" H,51,7.28,m, H,52,7.43,m, H,53,1.59,m, H,54,1.87,m, H,55,2.0,ddd,"12.4,11.6,4.6" H,56,2.0,ddd,"12.4,11.5,2.5" H,57,0.69,s, H,58,0.69,s, H,59,0.69,s, H,60,1.47,ddd,"10.5,9.9,8.7" H,61,2.0,m, H,62,2.0,m, H,63,2.0,ddd,"12.4,7.5,2.5" H,64,1.27,ddd,"12.4,11.5,7.8" H,65,0.69,s, H,66,0.69,s, H,67,0.69,s, H,68,4.05,dd,"5.6,5.4" H,69,2.86,qd,"6.3,5.4" H,70,0.95,d,6.3 H,71,0.95,d,6.3 H,72,0.95,d,6.3 H,73,2.86,s, H,74,2.86,s, H,75,2.86,s, H,76,2.86,s, H,77,2.86,s, H,78,2.86,s, H,79,2.86,ddd,"10.2,6.9,5.6" H,80,,, H,81,1.7,ddd,"12.4,10.3,6.9" H,82,2.58,ddd,"12.4,10.2,8.5" H,83,0.97,ddd,"12.0,10.3,8.5" H,84,1.47,m, H,85,2.0,m, H,86,1.47,tdd,"12.4,11.9,2.0" H,87,1.71,m, H,88,1.71,m, H,89,1.83,ddd,"12.3,5.0,2.3"