MMs01688299 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 58 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 0.7443 -1.3023 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4557 -1.3023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0114 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7329 -3.9004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2328 -3.9070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9885 -2.6112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2443 -1.3089 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6443 -0.2697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0132 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2442 -1.3221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2557 1.2759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7556 1.2693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5114 2.5651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7671 3.8674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5228 5.1631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0228 5.1565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7670 3.8542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0113 2.5585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7556 1.2562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2556 1.2496 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9999 -0.0528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4999 -0.0594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2556 1.2364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7556 1.2298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4998 -0.0725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7441 -1.3683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2442 -1.3617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0419 0.5954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5954 1.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0419 -0.5954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9273 -1.8227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9341 -3.3653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3966 -4.3058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -5.0830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0193 -5.0878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3587 -4.3223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9044 -3.3866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9112 -1.8439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4045 1.0287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1298 1.6913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4692 2.4568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5671 3.8727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9273 6.2050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6273 6.1931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9670 3.8489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8602 2.2861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8705 -0.4582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2031 -1.2354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6601 2.2782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3601 2.2664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6998 -0.0778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3396 -2.4101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6396 -2.3983 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 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 42 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 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 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 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 M END