C,1,56.01,s, O,2,,, C,3,165.39,s, C,4,96.47,s, C,5,161.59,s, O,6,,, C,7,106.91,s, C,8,180.1,s, O,9,,, C,10,134.89,s, O,11,,, C,12,105.6,s, O,13,,, C,14,75.5,s, C,15,67.88,s, O,16,,, C,17,101.15,s, O,18,,, C,19,69.92,s, C,20,18.0,s, C,21,72.72,s, O,22,,, C,23,74.52,s, O,24,,, C,25,78.76,s, O,26,,, C,27,110.5,s, O,28,,, C,29,75.4,s, C,30,74.8,s, O,31,,, C,32,71.31,s, O,33,,, C,34,102.46,s, O,35,,, C,36,74.84,s, C,37,78.67,s, O,38,,, C,39,61.95,s, O,40,,, C,41,76.05,s, O,42,,, C,43,78.17,s, O,44,,, C,45,70.0,s, O,46,,, C,47,74.9,s, O,48,,, C,49,73.55,s, O,50,,, C,51,162.0,s, C,52,121.94,s, C,53,131.68,s, C,54,115.77,s, C,55,160.49,s, O,56,,, C,57,115.77,s, C,58,131.68,s, O,59,,, C,60,157.41,s, C,61,92.43,s, H,62,3.83,s, H,63,3.83,s, H,64,3.83,s, H,65,6.38,d,1.9 H,66,,, H,67,5.05,d,2.4 H,68,3.62,dt,"9.5,5.3" H,69,4.21,d,5.3 H,70,4.21,d,5.3 H,71,4.97,d,2.5 H,72,3.81,qd,"6.1,5.2" H,73,1.27,d,6.1 H,74,1.27,d,6.1 H,75,1.27,d,6.1 H,76,3.46,dd,"6.9,5.2" H,77,,, H,78,3.44,dd,"6.9,4.5" H,79,,, H,80,4.19,dd,"4.5,2.5" H,81,5.49,d,3.1 H,82,4.04,s, H,83,4.04,s, H,84,,, H,85,4.31,s, H,86,4.31,s, H,87,5.18,d,7.5 H,88,4.57,s, H,89,4.57,s, H,90,,, H,91,3.89,s, H,92,3.89,s, H,93,,, H,94,4.13,d,7.5 H,95,,, H,96,4.13,d,3.1 H,97,,, H,98,3.88,dd,"9.5,6.7" H,99,,, H,100,3.52,dd,"6.7,0.9" H,101,,, H,102,3.51,dd,"2.4,0.9" H,103,,, H,104,8.01,ddd,"8.0,1.4,0.5" H,105,6.92,ddd,"8.0,1.9,0.5" H,106,,, H,107,6.92,ddd,"8.3,1.9,0.5" H,108,8.01,ddd,"8.3,1.4,0.5" H,109,6.48,d,1.9