IFLAB-ZINC04584368 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.0140 1.5500 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 0.0200 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -0.4510 -1.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -1.8750 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -2.2630 -2.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -1.8080 -2.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 -2.6460 -1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1040 -2.3010 -1.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5350 -0.9830 -2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5650 -0.1130 -2.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 -0.5790 -2.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 0.1380 -3.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 1.1500 -3.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2630 1.5380 -3.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2200 0.6870 -2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8700 -0.5700 -2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8140 -1.3960 -1.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1540 -0.9030 -1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0530 -1.9490 -1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5920 -3.0130 -0.7200 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3700 -1.7030 -0.9290 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1890 -2.6350 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9420 -3.9940 -0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7480 -4.9140 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8050 -4.4840 1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0550 -3.1220 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2500 -2.2000 0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1390 -2.9610 1.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7960 -4.2410 1.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7330 -5.1770 1.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 1.9260 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.9050 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 1.9090 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -0.3350 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 -0.3560 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 -2.2690 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -2.2900 -1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -3.3460 -2.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -1.7950 -3.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 -3.6210 -1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8190 -2.9900 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2080 1.8200 -3.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5560 2.5160 -3.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2490 1.0100 -2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4930 -0.6730 -2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1870 0.0010 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7510 -0.8800 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1180 -4.3320 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5540 -5.9710 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4450 -1.1430 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5530 -4.2970 1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2410 -4.4260 2.9670 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 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 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 11 1 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 16 2 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 17 18 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 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 M END