MMs00652179 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 0.7528 -1.2974 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2528 -1.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2528 -1.2876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5057 -2.5883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0057 -2.5915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2585 -3.8922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0113 -5.1896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7528 -1.2843 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.0164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7471 1.3138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7528 -1.2778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2528 -1.2745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 0.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2471 1.3236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7471 1.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 0.0295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2471 1.3301 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.7386 1.4902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0472 2.9581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7466 3.7052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6340 2.6991 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.4162 3.5712 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0379 0.6023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6023 1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0379 -0.6023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3977 1.0445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0977 1.0504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1079 -3.6262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9734 -5.7919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6136 -6.2275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0492 -4.5873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3551 -2.3222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1551 -2.3183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8551 -2.3124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8449 2.3641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1449 2.3582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2942 -1.1528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6285 -0.3785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5435 0.6002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6185 4.8984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 M END