IBS-ZINC02129990 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 64 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6990 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0830 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7730 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0840 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6920 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.2230 -2.5240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -1.2280 -3.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -1.1200 -4.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -2.5090 -2.6340 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2420 -3.3530 -2.9820 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6980 -3.8090 -2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 -4.4030 -4.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9010 -5.4300 -3.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -4.0820 -4.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9320 -3.4370 -5.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -5.3740 -4.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0460 -5.0310 -4.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8410 -6.3030 -4.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 -7.3780 -4.6420 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1620 -6.2460 -5.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -4.0490 -5.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -4.6280 -6.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 -2.9960 -5.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 -2.5210 -3.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 -1.5850 -3.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1110 -2.4070 -6.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 -1.3280 -6.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 -0.0240 -6.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 0.9700 -7.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 0.6600 -8.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -0.6540 -8.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -1.6430 -7.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -0.6990 -9.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 0.6640 -10.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 1.4380 -8.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 0.1670 2.7000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6230 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -3.8530 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 0.7170 -2.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 -5.9620 -5.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 -5.9490 -3.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4520 -4.4420 -3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1090 -4.4550 -5.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6020 -5.3870 -5.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6740 -7.0650 -5.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -1.9760 -5.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 -3.1790 -6.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 0.2200 -5.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7370 1.9880 -6.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -2.6620 -8.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 0.8900 -10.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 0.8490 -10.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -3.3540 -2.9420 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3430 -4.0040 -2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 5 6 2 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 58 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 26 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 58 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 2 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 53 1 0 0 0 0 31 32 1 0 0 0 0 31 54 1 0 0 0 0 32 33 2 0 0 0 0 32 37 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 34 55 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 36 56 1 0 0 0 0 36 57 1 0 0 0 0 58 59 1 0 0 0 0 M END