C,1,28.34,s, C,2,30.8,s, C,3,28.34,s, C,4,33.93,s, C,5,32.65,s, C,6,46.27,s, C,7,181.68,s, O,8,,, O,9,,, C,10,23.26,s, C,11,28.48,s, C,12,42.15,s, C,13,24.21,s, C,14,144.09,s, C,15,122.07,s, C,16,22.9,s, C,17,46.4,s, C,18,35.1,s, C,19,17.6,s, C,20,46.97,s, C,21,68.7,s, O,22,,, C,23,85.05,s, O,24,,, C,25,42.73,s, C,26,20.29,s, C,27,65.67,s, O,28,,, C,29,46.7,s, C,30,65.7,s, O,31,,, C,32,39.7,s, C,33,38.0,s, C,34,17.3,s, C,35,41.8,s, C,36,46.31,s, H,37,0.94,s, H,38,0.94,s, H,39,0.94,s, H,40,0.94,s, H,41,0.94,s, H,42,0.94,s, H,43,1.34,ddd,"12.4,4.1,3.6" H,44,1.34,ddd,"13.7,12.4,4.2" H,45,1.73,ddd,"13.7,12.4,3.6" H,46,1.73,ddd,"12.4,4.2,4.1" H,47,,, H,48,1.89,ddd,"12.4,7.1,2.5" H,49,1.89,ddd,"12.4,11.4,7.6" H,50,1.65,ddd,"12.4,7.6,2.5" H,51,1.65,ddd,"12.4,11.4,7.1" H,52,1.31,s, H,53,1.31,s, H,54,1.31,s, H,55,5.43,dd,"5.7,2.6" H,56,1.93,ddd,"15.4,5.7,2.4" H,57,1.93,ddd,"15.4,13.3,2.6" H,58,1.76,dd,"13.3,2.4" H,59,1.04,s, H,60,1.04,s, H,61,1.04,s, H,62,2.21,dd,"12.4,8.8" H,63,2.21,dd,"12.4,8.0" H,64,3.59,ddd,"8.8,8.0,1.1" H,65,,, H,66,4.13,d,1.1 H,67,,, H,68,1.24,s, H,69,1.24,s, H,70,1.24,s, H,71,4.12,s, H,72,4.12,s, H,73,,, H,74,2.26,d,2.6 H,75,4.19,ddd,"4.3,3.8,2.6" H,76,,, H,77,2.1,dd,"12.4,3.8" H,78,2.1,dd,"12.4,4.3" H,79,1.09,s, H,80,1.09,s, H,81,1.09,s, H,82,3.25,dd,"10.5,7.2" H,83,1.58,dd,"12.4,10.5" H,84,1.58,dd,"12.4,7.2"