MMs00941523 MOE2007 2D CORINA 3.40 0006 02.08.2006 64 65 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 -0.0119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5205 2.5861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2808 3.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7602 1.2693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0356 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0999 1.0036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7396 -1.3287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.0475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7395 -1.3524 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2395 -1.3643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 -0.0712 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9792 -2.6692 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7792 -2.6692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2189 -3.9623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9586 -5.2672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4586 -5.2791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2188 -3.9860 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4791 -2.6811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7188 -3.9979 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.7069 -5.4978 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7306 -2.4979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2187 -4.0097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9584 -5.3147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4584 -5.3265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2186 -4.0335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4789 -2.7285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9790 -2.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7186 -4.0453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0095 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0095 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2822 -1.1920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0621 -0.2215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6074 3.3647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5952 1.8221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3152 3.2710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 4.9136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2463 4.4874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8910 1.6708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5611 2.4527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2224 -1.0246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1314 -2.3631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7741 -1.9369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8008 1.1359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1307 0.3540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1313 -2.3868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3058 -3.1837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2936 -4.7263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8278 -5.6687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1576 -6.4506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2408 -6.4591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5829 -5.6984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2801 -1.4977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6100 -2.2796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3502 -6.3491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0501 -6.3705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0871 -1.6941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3872 -1.6727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7091 -5.2453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9185 -4.0548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7281 -2.8454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2602 1.2812 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0602 1.2812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 63 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 63 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 5 63 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 47 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 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 28 59 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 63 64 1 0 0 0 0 M CHG 1 63 1 M END