IBS-ZINC05253022 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 -0.6950 1.7480 1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 0.2260 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -0.3220 2.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -1.6730 2.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -2.4540 1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -3.8240 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -4.4390 2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -3.6520 3.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -2.2660 3.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -4.5790 4.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 -5.8660 3.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -5.7650 2.5180 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -6.5150 1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 -6.9480 4.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 -6.7050 5.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 -5.4750 5.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 -4.4290 5.2460 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 -8.2450 3.8680 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7150 -9.3650 4.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 -10.6770 3.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 -11.9510 5.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2160 -12.9540 6.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -12.4600 5.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8570 -13.0460 3.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9900 -13.1210 2.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 -13.0730 3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 2.1560 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 2.1660 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 2.0080 2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 -0.1820 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -0.0330 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 -1.9830 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 -4.4210 0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -1.6580 3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 -5.3220 6.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -8.4110 3.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7980 -9.2410 4.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 -9.3890 5.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 -10.8020 3.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7330 -10.6540 2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 -10.9870 6.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 -13.9420 6.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2600 -12.6430 6.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 -12.9920 7.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -12.4570 6.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -11.8090 5.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -13.4740 5.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 -13.8980 4.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9480 -13.0120 3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 -14.0840 2.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8730 -12.3190 2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -14.0400 2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -12.9140 3.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 -12.2830 2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 -11.8000 4.6030 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 17 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 41 1 0 0 0 0 21 55 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 48 1 0 0 0 0 24 55 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 M END