C,1,12.72,s, C,2,118.86,s, C,3,140.39,s, C,4,46.86,s, N,5,,, C,6,57.09,s, C,7,34.0,s, C,8,53.0,s, C,9,174.7,s, O,10,,, N,11,,, O,12,,, C,13,63.4,s, C,14,139.75,s, C,15,101.61,s, C,16,158.96,s, O,17,,, C,18,55.46,s, C,19,104.5,s, C,20,120.6,s, C,21,132.0,s, C,22,78.41,s, C,23,35.12,s, C,24,42.38,s, C,25,40.4,s, C,26,70.43,s, O,27,,, H,28,1.67,d,7.0 H,29,1.67,d,7.0 H,30,1.67,d,7.0 H,31,5.45,q,7.0 H,32,4.69,s, H,33,4.69,s, H,34,,, H,35,3.7,ddd,"8.5,7.9,2.9" H,36,2.15,dd,"12.4,8.5" H,37,2.15,dd,"12.4,7.9" H,38,3.73,s, H,39,3.73,s, H,40,3.73,s, H,41,7.09,dd,"1.9,0.5" H,42,3.84,s, H,43,3.84,s, H,44,3.84,s, H,45,6.93,dd,"9.4,1.9" H,46,7.56,dd,"9.4,0.5" H,47,4.77,dd,"8.4,1.0" H,48,1.88,ddd,"12.4,8.6,1.0" H,49,1.88,ddd,"12.4,9.3,8.4" H,50,2.99,ddd,"9.3,8.6,4.0" H,51,2.83,tdd,"4.0,2.9,2.6" H,52,4.04,dd,"9.4,2.6" H,53,4.04,dd,"9.4,4.0"