MMs03922728 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 60 0 0 1 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3041 0.7411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3143 2.2411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 -1.5176 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5878 -2.7176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8817 -2.2765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8715 -3.7764 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1858 -1.5353 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4797 -2.2942 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4797 -1.0942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4695 -3.7941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7634 -4.5529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0675 -3.8118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7532 -6.0529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7838 -1.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0777 -2.3118 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3819 -1.5707 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.4211 -0.9707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 -0.0707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6962 0.6704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 -0.0884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7064 2.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6758 -2.3295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9799 -1.5884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6655 -3.8295 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5929 1.0433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0433 -0.5929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5929 -1.0433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2649 1.3411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5143 2.2329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3225 3.4411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1144 2.2493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0161 1.1071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7783 -0.2341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1940 -0.3354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2892 -3.5777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0514 -4.9189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8026 -5.1529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6604 -4.8551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1108 -3.2189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4746 -2.7685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5532 -6.0447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7450 -7.2529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9532 -6.0611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0737 -2.9118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2089 -0.2711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9893 1.0597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7354 1.2704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3830 -1.1235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0252 -0.6955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5971 0.9467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9064 2.1622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7146 3.3703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5064 2.1785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6223 -4.4224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7007 -4.4365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2486 -1.6517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2837 -2.2588 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2755 -3.4588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 60 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 M END