IBS-ZINC02255879 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -0.5820 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -2.1080 1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 -2.7270 2.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -4.1880 2.1030 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 -4.9490 3.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 -4.4230 4.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 -6.4060 2.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -7.3010 3.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -8.6540 3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -9.6820 3.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6450 -9.4850 4.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -10.5800 4.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 -10.3700 5.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9940 -9.0820 5.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 -7.9990 5.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 -8.1760 4.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 -7.1180 4.1610 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -8.5300 2.4180 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -7.2180 2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9110 -6.7650 1.6810 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 -9.6020 1.8890 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9180 -10.0110 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 -11.1400 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 -11.5770 -1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1620 -12.6370 -1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1230 -13.2280 -0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3240 -12.7450 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 -11.7310 0.8620 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 -0.2470 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -0.2720 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -2.4430 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -2.4180 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 -2.3910 2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -2.4170 3.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 -4.6060 1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 -11.5830 4.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2050 -11.2140 5.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9100 -8.9420 6.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5690 -7.0070 5.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1020 -5.8150 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5170 -7.3960 1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 -9.5260 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -11.0940 -1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9870 -12.9970 -2.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7090 -14.0570 -1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0710 -13.2030 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 21 2 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 M END