MMs02930798 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 0.7461 -1.3013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0077 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7384 -3.8993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0154 -5.1961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2384 -3.9038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9923 -2.6070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2461 -1.3057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2461 -1.3146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4923 -2.6114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7461 -1.3191 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7538 1.2790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0267 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4000 -1.0660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7461 -1.3280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7538 1.2701 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2461 1.4224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5623 2.8887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2655 3.6426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1478 2.6422 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9344 3.4947 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 12.2464 0.3047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 0.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5969 1.0410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 -0.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2077 -2.5945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4031 1.0321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1031 1.0241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0892 -3.6524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3430 -2.3601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7051 -1.9249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3430 -2.3690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7871 -0.7311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1436 4.8364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3523 -0.4956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0467 -0.5894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1406 1.1050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 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 18 1 0 0 0 0 16 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 M END