C,1,15.05,s, C,2,42.36,s, C,3,77.16,s, O,4,,, C,5,132.07,s, C,6,153.07,s, O,7,,, C,8,153.07,s, C,9,132.07,s, C,10,77.16,s, O,11,,, C,12,45.83,s, C,13,44.63,s, C,14,41.45,s, C,15,28.19,s, C,16,28.19,s, C,17,42.11,s, C,18,37.64,s, H,19,0.89,d,6.6 H,20,0.89,d,6.6 H,21,0.89,d,6.6 H,22,1.84,qdd,"6.6,4.2,2.2" H,23,4.42,d,2.2 H,24,,, H,25,8.49,s, H,26,7.67,s, H,27,4.12,d,10.4 H,28,,, H,29,2.12,m, H,30,2.0,dd,"12.4,0.4" H,31,1.75,dd,"12.4,6.7" H,32,0.94,s, H,33,0.94,s, H,34,0.94,s, H,35,0.94,s, H,36,0.94,s, H,37,0.94,s, H,38,1.47,dd,"12.4,5.1" H,39,1.0,dd,"12.5,12.4" H,40,1.42,m,