C,1,56.14,s, O,2,,, C,3,148.82,s, C,4,111.81,s, C,5,127.62,s, C,6,145.6,s, C,7,115.0,s, C,8,167.5,s, O,9,,, O,10,,, C,11,80.3,s, C,12,24.01,s, C,13,37.5,s, C,14,36.6,s, C,15,15.68,s, C,16,46.7,s, C,17,23.99,s, C,18,121.7,s, C,19,145.1,s, C,20,47.3,s, C,21,46.7,s, C,22,31.1,s, C,23,28.5,s, C,24,28.5,s, C,25,34.7,s, C,26,37.1,s, C,27,32.5,s, C,28,28.4,s, C,29,26.9,s, C,30,25.84,s, C,31,41.9,s, C,32,25.9,s, C,33,39.67,s, C,34,16.87,s, C,35,32.9,s, C,36,18.6,s, C,37,55.6,s, C,38,38.45,s, C,39,22.27,s, C,40,22.27,s, C,41,123.82,s, C,42,115.55,s, C,43,149.13,s, O,44,,, H,45,3.86,s, H,46,3.86,s, H,47,3.86,s, H,48,7.1,dd,"1.9,0.5" H,49,7.55,d,16.0 H,50,6.33,d,16.0 H,51,4.56,dd,"11.7,5.7" H,52,1.84,m, H,53,1.84,m, H,54,1.97,ddd,"12.7,12.4,6.3" H,55,1.97,ddd,"12.4,5.7,2.1" H,56,0.88,s, H,57,0.88,s, H,58,0.88,s, H,59,1.82,dd,"12.4,2.6" H,60,2.0,ddd,"15.4,12.4,2.8" H,61,2.0,ddd,"15.4,6.2,2.6" H,62,5.43,dd,"6.2,2.8" H,63,2.94,dd,"12.8,3.7" H,64,2.22,dd,"12.4,3.7" H,65,2.22,dd,"12.8,12.4" H,66,0.94,s, H,67,0.94,s, H,68,0.94,s, H,69,0.94,s, H,70,0.94,s, H,71,0.94,s, H,72,1.38,ddd,"12.4,7.2,1.5" H,73,1.38,ddd,"12.4,10.5,8.3" H,74,1.49,ddd,"12.4,8.3,1.5" H,75,1.49,ddd,"12.4,10.5,7.2" H,76,0.95,s, H,77,0.95,s, H,78,0.95,s, H,79,1.54,ddd,"12.4,12.0,7.5" H,80,1.54,ddd,"12.4,6.3,2.5" H,81,1.63,ddd,"12.4,12.0,6.3" H,82,1.63,ddd,"12.4,7.5,2.5" H,83,1.27,s, H,84,1.27,s, H,85,1.27,s, H,86,1.08,s, H,87,1.08,s, H,88,1.08,s, H,89,1.49,ddd,"12.4,10.4,8.8" H,90,1.49,ddd,"12.4,11.5,1.4" H,91,1.46,m, H,92,1.46,m, H,93,1.22,dd,"11.6,6.7" H,94,0.88,s, H,95,0.88,s, H,96,0.88,s, H,97,0.88,s, H,98,0.88,s, H,99,0.88,s, H,100,6.97,dd,"7.5,1.9" H,101,6.8,dd,"7.5,0.5" H,102,,,