MMs02529403 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 54 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 -0.7566 -1.2952 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2566 -1.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 0.0154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 0.0230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2566 -1.2721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5132 -2.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0133 -2.5827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2699 -3.8702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7699 -3.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7793 -4.9721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1464 -4.3549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9820 -2.8640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5132 -2.5596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7566 -1.2645 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.4493 -5.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4570 -6.5983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.7445 -4.3416 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.0473 -5.0850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3425 -4.3283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3348 -2.8284 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.0320 -2.0850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7368 -2.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6300 -2.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6223 -0.5717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.9175 0.1849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.2204 -0.5584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.2281 -2.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.9329 -2.8150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.5309 -2.8017 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0361 -0.6053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6053 1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0361 0.6053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3946 1.0515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0946 1.0653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4186 -3.6250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6752 -4.9125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5358 -6.1471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2807 -6.0082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8234 -6.0003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7587 -5.4538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5232 -4.1139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7986 -1.1618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2559 -1.1697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5561 -3.0561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3206 -1.7161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5800 0.0229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.9114 1.3849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.2565 0.0469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.9390 -4.0150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 15 2 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 36 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 14 2 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 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 23 1 0 0 0 0 19 20 1 0 0 0 0 19 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 24 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 50 1 0 0 0 0 M END