IBS-ZINC02433950 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 61 0 0 0 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 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8250 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -2.6740 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -4.0400 0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -4.5860 1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -3.7310 2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 -2.3480 2.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 -4.5950 3.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -5.9150 3.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -5.8920 1.9660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 -6.6780 1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -6.9480 3.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 -6.6310 5.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 -5.3720 5.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8510 -4.3690 4.7000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -8.2750 3.6070 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 -9.1770 4.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7120 -10.6250 4.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -10.9240 3.9500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -10.0220 2.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -8.5740 3.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 -12.2610 3.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 -12.7580 2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -14.0800 2.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -14.9090 2.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -14.4170 4.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 -13.0970 4.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -12.5640 5.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 -14.6200 0.8150 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 -0.2600 -2.2570 -0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -4.6900 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 -1.6890 3.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 -5.1580 6.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9300 -8.9440 4.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 -9.0470 5.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2350 -10.7620 3.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1310 -11.2970 4.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -10.1520 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 -10.2550 2.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 -8.4380 4.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -7.9020 2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 -12.1110 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -15.9420 2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -15.0670 4.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -12.1760 5.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -13.3670 6.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -11.7640 6.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 -15.0110 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -15.4200 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -13.8200 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 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 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 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 39 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 40 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 M END