MMs01140653 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 42 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 1.2359 0.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2747 2.3495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7128 2.7760 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5628 1.5401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 0.3498 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0623 1.5013 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8456 2.7805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1295 4.0985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3451 2.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1285 4.0210 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4123 5.3389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9128 5.3777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1956 6.6182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6280 3.9822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4113 5.2614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3441 2.6642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5608 1.3850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2770 0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7765 0.0282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5598 1.3074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8436 2.6254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0593 1.2686 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 0.9887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9887 -0.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -0.9887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3224 3.0797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6352 0.4469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1063 1.5658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4618 2.3023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8123 6.3782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9438 6.5773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7132 5.4087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8818 4.1781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2190 5.9915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8223 7.6415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1723 7.2448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3612 1.4160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6503 -0.9564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3494 -1.0262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4703 3.6488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 17 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 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 41 1 0 0 0 0 M END