MMs01372043 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 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 0.8892 -1.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2877 -2.5821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1769 -3.7901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6677 -3.6240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2692 -2.2499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 -1.0419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9816 0.3322 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4723 0.4983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2142 1.8019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6834 1.4992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8494 0.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4830 -0.6102 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.1531 -0.7334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1625 -2.2334 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4475 0.0246 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7512 -0.7173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7605 -2.2172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0642 -2.9591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3585 -2.2010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3492 -0.7011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0455 0.0408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6435 0.0570 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.7918 2.5098 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5956 3.1684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4697 4.3874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1029 3.3159 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9664 0.7114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7114 0.9664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9664 -0.7114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -2.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6956 -4.8894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3790 -4.5904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4618 -2.1171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2702 1.2986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4400 1.2246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7250 -2.8237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0717 -4.1591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4015 -2.7946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0380 1.2408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9354 2.1461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5350 3.6820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 4.4091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4036 2.3407 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 M END