MMs01568513 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 -0.1376 -1.4937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9899 -2.4830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3974 -3.8610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0963 -3.7234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 -2.2603 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4530 -2.1523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0454 -0.7743 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5391 -0.9119 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8698 -2.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5805 -3.1416 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4428 -4.6353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2478 -2.9675 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4499 -2.0703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8280 -2.6628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0039 -4.1524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0301 -1.7656 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4081 -2.3581 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.6102 -1.4609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4343 0.0287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9882 -2.0534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1642 -3.5430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5422 -4.1355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7443 -3.2383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5684 -1.7487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1904 -1.1562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1949 -0.1101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1101 1.1949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1949 0.1101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0107 -4.8925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8877 -4.6254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2479 -4.5252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3327 -5.8302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6378 -4.7454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5761 -1.2479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1081 -1.0670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8893 -0.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5488 -3.5498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2025 -4.2608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6829 -5.3272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8467 -3.7123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5301 -1.0310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0496 0.0355 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 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 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 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 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 M END