MMs03516853 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 0.9522 -1.1590 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5743 -2.6106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8381 -3.4186 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9971 -2.4663 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4496 -1.0698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2576 0.1939 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7561 0.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5640 1.3899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0625 1.3220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7530 -0.0096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2514 -0.0775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9419 -1.4091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1339 -2.6729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6354 -2.6050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9450 -1.2734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8222 -3.1581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2001 -4.6097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6975 -4.6988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6331 -5.8712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1163 -5.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6638 -4.2506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7281 -3.0782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2450 -3.3023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 -2.3501 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2479 -5.7687 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9272 0.7618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7618 0.9272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9272 -0.7618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4944 -1.0450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8640 -0.3349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0117 2.4552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7089 2.3330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8978 0.9335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1407 -1.4634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6863 -3.7382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9891 -3.6161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7462 -1.2191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1951 -6.9885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8648 -6.5850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8503 -4.0713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1661 -1.9610 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 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 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 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 M END