MMs01982966 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 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 1.4989 -0.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2988 1.2105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7977 1.1521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4966 -0.1751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6966 -1.4440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1977 -1.3856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6562 -2.5969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0492 -2.0406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9506 -0.5439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3181 -2.8406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2597 -4.3395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6453 -2.1417 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9142 -2.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2414 -2.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2998 -0.7440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6270 -0.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8959 -0.8451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8375 -2.3439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5103 -3.0428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2231 -0.1462 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.5242 1.1811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9220 -1.4734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5504 0.5527 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2874 -4.0509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0467 1.1991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1991 0.0467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0467 -1.1991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7397 2.2723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4377 2.1672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5578 -2.4007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6920 -0.9426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1076 -3.8302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6491 -3.8903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2847 -0.1040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6737 1.1540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8526 -2.9839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4636 -4.2419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5655 -0.0873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5971 1.7518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1243 -3.7559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9924 -5.2141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4506 -4.3459 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 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M END