IBS-ZINC04026884 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1920 -2.3990 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -2.5580 2.4210 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5970 -2.1280 2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 -4.0880 2.3110 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1010 -4.3720 1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 -4.6200 2.3940 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6460 -3.9810 1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -2.5450 1.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 -4.3590 3.7890 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0840 -5.0900 4.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -2.9800 4.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -2.1760 3.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -0.8240 4.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 -4.5100 3.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -6.1340 2.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 -6.6470 2.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 -4.6580 3.4610 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 -1.0200 -0.3810 0.0100 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -4.3220 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6820 -4.2860 1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 -2.6190 5.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -0.0920 3.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -0.8770 5.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -0.5260 4.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 -5.5210 3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2580 -4.3240 4.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2770 -3.7910 3.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -6.3500 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -6.6040 2.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 -7.6030 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 -4.3830 4.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 -5.7440 3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -4.2520 3.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 16 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 M END