IBS-ZINC05298088 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 68 0 0 1 0 0 0 0 0999 V2000 0.8520 1.6520 -0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 0.1340 -0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 -0.3880 0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -0.4770 -0.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -1.6030 -1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -2.1800 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 -3.3240 -1.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -3.8940 -2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -3.3210 -2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -2.1730 -1.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -5.1430 -3.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 -5.9620 -5.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 -5.5510 -6.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6100 -6.8010 -7.7430 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9160 -7.4560 -7.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0760 -6.4880 -7.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1220 -6.1400 -8.9120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9460 -5.4810 -9.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 -6.4080 -9.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1190 -5.1330 -10.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7200 -4.1990 -8.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 -7.7890 -7.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 -8.9780 -8.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -8.9830 -9.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 -10.0730 -10.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 -11.1610 -10.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 -11.1580 -8.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 -10.0680 -8.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0380 -10.0670 -6.4020 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 2.1180 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 2.0240 -1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 1.8950 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -0.1090 -1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 -1.4700 0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 0.0780 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -0.1450 1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5830 -1.7360 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9890 -3.7750 -1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 -3.7680 -3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -1.7230 -1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -5.7300 -3.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 -5.7330 -2.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 -6.4320 -5.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -6.6680 -5.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2230 -4.9100 -6.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -5.0070 -7.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0810 -8.3730 -7.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8520 -7.6880 -6.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0140 -6.9660 -7.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -5.5880 -6.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 -5.8920 -9.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8820 -7.3050 -9.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9780 -4.4730 -10.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2220 -4.6300 -11.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2790 -6.0470 -11.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2480 -4.2680 -7.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6540 -4.0690 -8.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0970 -3.3460 -9.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -7.3010 -7.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -8.1210 -6.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 -8.1340 -10.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -10.0760 -11.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 -12.0120 -10.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 -12.0070 -8.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6570 -4.7720 -4.6840 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -4.1100 -4.6560 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 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 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 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 11 65 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 12 65 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 21 58 1 0 0 0 0 22 23 1 0 0 0 0 22 59 1 0 0 0 0 22 60 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 61 1 0 0 0 0 25 26 1 0 0 0 0 25 62 1 0 0 0 0 26 27 2 0 0 0 0 26 63 1 0 0 0 0 27 28 1 0 0 0 0 27 64 1 0 0 0 0 28 29 1 0 0 0 0 65 66 1 0 0 0 0 M END