IBS-ZINC05091724 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -1.9630 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 -2.4310 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 -2.0750 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 -0.5720 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 -0.1600 -1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 -2.8110 -2.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 -4.2900 -2.0600 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4100 -4.7470 -1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9090 -4.5950 -3.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 -3.2710 -4.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -2.3520 -3.1940 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -3.0620 -5.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 -1.8730 -5.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -1.9340 -7.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 -3.1420 -7.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 -4.3100 -6.6830 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.5570 -4.6670 -1.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0290 -5.9400 -1.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2940 -6.3180 -1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0920 -5.4200 -0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6290 -4.1460 -0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3530 -3.7530 -0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9990 -2.4700 -0.7200 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4200 -3.2680 0.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7120 -3.7320 0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 -2.1960 1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 -2.4730 -0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 -3.5110 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3010 -1.9380 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0620 -0.3310 -2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0150 -0.0340 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -0.6800 -2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 0.9160 -1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 -5.3590 -3.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8290 -4.9060 -4.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 -0.9580 -5.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -1.0670 -7.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 -3.3690 -8.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4040 -6.6410 -2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6570 -7.3120 -1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0800 -5.7150 -0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2820 -4.0210 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6020 -4.5930 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2370 -2.9350 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -0.5120 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 55 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 55 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 26 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 42 1 0 0 0 0 8 43 1 0 0 0 0 8 55 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 2 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 M END