PUBCHEM-ZINC05385832 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 72 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 -1.3760 -0.5120 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -1.9610 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -2.2420 -1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -2.5650 -1.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -2.8140 -3.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.7570 -4.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 -2.4280 -3.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -2.1850 -2.6360 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 -2.3750 -5.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -2.6380 -6.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 -2.9400 -6.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -3.0020 -5.3610 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -3.2040 -7.6380 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5910 -2.0630 -4.8790 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 -0.1970 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 0.6500 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7550 0.9640 2.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2890 0.4320 3.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1790 -0.4180 3.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 -0.7330 2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -1.7940 2.4080 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 0.7670 4.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9320 1.5070 4.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 0.2530 6.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1890 0.5850 7.2750 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.2600 0.6840 7.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9400 -0.5270 8.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6000 -1.8200 7.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3550 -2.9150 8.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7180 -2.6850 9.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8450 -4.1460 8.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5700 -5.1510 9.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2040 -6.4800 9.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 1.8860 7.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7840 2.4750 7.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1170 2.3910 8.9580 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 3.6470 9.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2050 4.0610 10.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6990 1.3120 -0.2950 Cl 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 0.5120 -0.3560 -0.8950 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 -0.7510 -2.4630 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 -2.3290 -0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 -2.6100 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -3.1650 -8.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 -3.4260 -7.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9490 -1.8740 -3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1710 -2.0330 -5.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 1.6220 2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 -0.8310 4.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7460 -0.3380 6.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8670 -0.6860 8.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 -0.2390 9.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6730 -1.6600 7.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1760 -2.1080 6.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4930 -5.2790 9.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9900 -4.8320 10.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2820 -6.3530 9.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7840 -6.8000 8.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 -7.2350 9.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 3.5260 9.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7230 4.4170 8.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7780 5.0040 11.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2780 4.1820 10.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0290 3.2910 11.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 45 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 47 1 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 49 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 14 2 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 36 1 0 0 0 0 29 30 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 34 61 1 0 0 0 0 34 62 1 0 0 0 0 35 63 1 0 0 0 0 35 64 1 0 0 0 0 35 65 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 39 66 1 0 0 0 0 39 67 1 0 0 0 0 40 68 1 0 0 0 0 40 69 1 0 0 0 0 40 70 1 0 0 0 0 M END