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,27,45.65,s, C,28,32.23,s, C,29,29.3,s, C,30,29.3,s, C,31,42.83,s, C,32,78.41,s, O,33,,, C,34,170.18,s, C,35,21.24,s, O,36,,, C,37,41.86,s, C,38,72.44,s, O,39,,, C,40,170.74,s, C,41,20.86,s, O,42,,, C,43,75.84,s, O,44,,, C,45,35.14,s, C,46,42.5,s, C,47,27.1,s, H,48,2.07,s, H,49,2.07,s, H,50,2.07,s, H,51,4.6,s, H,52,4.6,s, H,53,0.82,s, H,54,0.82,s, H,55,0.82,s, H,56,5.07,dd,"11.2,4.6" H,57,2.01,s, H,58,2.01,s, H,59,2.01,s, H,60,2.19,m, H,61,2.19,m, H,62,1.97,ddd,"12.4,12.1,7.4" H,63,1.97,ddd,"12.4,5.7,2.9" H,64,0.9,s, H,65,0.9,s, H,66,0.9,s, H,67,2.15,dd,"12.6,4.4" H,68,1.52,m, H,69,1.52,m, H,70,1.49,ddd,"12.4,3.9,3.7" H,71,1.49,ddd,"13.5,12.4,5.5" H,72,0.89,s, H,73,0.89,s, H,74,0.89,s, H,75,1.82,dd,"13.4,6.7" H,76,2.0,ddd,"15.4,6.7,3.9" H,77,2.0,ddd,"15.4,13.4,3.3" H,78,5.43,dd,"3.9,3.3" H,79,2.94,dd,"11.7,3.3" H,80,2.22,dd,"12.4,11.7" H,81,2.22,dd,"12.4,3.3" H,82,1.16,s, H,83,1.16,s, H,84,1.16,s, H,85,1.16,s, H,86,1.16,s, H,87,1.16,s, H,88,2.79,dd,"12.4,11.2" H,89,2.79,dd,"12.4,5.5" H,90,6.15,dd,"11.2,5.5" H,91,2.01,s, H,92,2.01,s, H,93,2.01,s, H,94,4.13,s, H,95,4.13,s, H,96,2.07,s, H,97,2.07,s, H,98,2.07,s, H,99,4.12,dd,"9.9,1.6" H,100,,, H,101,2.06,dd,"12.4,1.6" H,102,2.06,dd,"12.4,9.9" H,103,1.18,s, H,104,1.18,s, H,105,1.18,s,