C,1,20.86,s, C,2,170.74,s, O,3,,, O,4,,, C,5,67.27,s, C,6,42.73,s, C,7,20.29,s, C,8,78.41,s, O,9,,, C,10,170.18,s, C,11,21.24,s, O,12,,, C,13,26.7,s, C,14,38.94,s, C,15,37.3,s, C,16,16.08,s, C,17,51.09,s, C,18,18.82,s, C,19,33.06,s, C,20,40.7,s, C,21,18.0,s, C,22,47.78,s, C,23,23.99,s, C,24,126.6,s, C,25,141.0,s, C,26,47.74,s, C,27,48.1,s, C,28,36.6,s, C,29,24.45,s, C,30,24.45,s, C,31,79.7,s, O,32,,, C,33,172.7,s, C,34,21.0,s, O,35,,, C,36,73.9,s, O,37,,, C,38,169.89,s, C,39,20.79,s, O,40,,, C,41,41.86,s, C,42,72.44,s, O,43,,, C,44,170.74,s, C,45,20.86,s, O,46,,, C,47,75.84,s, O,48,,, C,49,35.14,s, C,50,42.5,s, C,51,27.1,s, H,52,2.07,s, H,53,2.07,s, H,54,2.07,s, H,55,4.6,s, H,56,4.6,s, H,57,0.82,s, H,58,0.82,s, H,59,0.82,s, H,60,5.07,dd,"9.0,6.7" H,61,2.01,s, H,62,2.01,s, H,63,2.01,s, H,64,2.19,m, H,65,2.19,m, H,66,1.97,ddd,"12.4,10.7,1.2" H,67,1.97,ddd,"12.4,11.7,4.6" H,68,0.9,s, H,69,0.9,s, H,70,0.9,s, H,71,2.15,dd,"10.6,6.3" H,72,1.52,m, H,73,1.52,m, H,74,1.49,ddd,"12.4,11.4,1.4" H,75,1.49,ddd,"12.4,9.9,8.2" H,76,0.89,s, H,77,0.89,s, H,78,0.89,s, H,79,1.82,dd,"10.8,10.6" H,80,2.0,ddd,"15.4,10.6,3.0" H,81,2.0,ddd,"15.4,10.8,4.4" H,82,5.43,dd,"4.4,3.0" H,83,2.94,dd,"13.2,1.9" H,84,2.04,dd,"12.4,1.9" H,85,2.04,dd,"13.2,12.4" H,86,0.99,s, H,87,0.99,s, H,88,0.99,s, H,89,0.99,s, H,90,0.99,s, H,91,0.99,s, H,92,4.77,s, H,93,2.0,s, H,94,2.0,s, H,95,2.0,s, H,96,4.77,s, H,97,2.0,s, H,98,2.0,s, H,99,2.0,s, H,100,4.13,s, H,101,4.13,s, H,102,2.07,s, H,103,2.07,s, H,104,2.07,s, H,105,4.12,dd,"10.2,2.7" H,106,,, H,107,2.06,dd,"12.4,10.2" H,108,2.06,dd,"12.4,2.7" H,109,1.18,s, H,110,1.18,s, H,111,1.18,s,