MMs02978591 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 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 1.5000 -0.0020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2517 1.2960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7517 1.2940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7483 -1.3040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2483 -1.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4965 -2.6041 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0080 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7517 1.2900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0035 2.5901 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2517 1.2880 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0035 2.5861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2552 3.8861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7636 4.0449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4537 5.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7537 6.2608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8671 5.2556 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0120 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6000 -1.0512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2483 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -0.0140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3833 1.1984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8093 0.7329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8073 -0.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3801 -1.2287 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0016 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0016 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6531 2.3361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3531 2.3325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6469 -2.3405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5986 -1.0480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9217 1.8135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9237 3.3562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9595 3.1542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3581 6.0021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8808 7.4541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2098 -0.7086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6469 -2.3485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2867 -1.9114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0140 2.3401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7810 1.4370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7771 -1.4737 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 M END