IBS-ZINC02198797 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -1.5870 1.6560 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 0.2030 0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -0.6850 1.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 -1.9240 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -1.7970 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 -0.4710 -0.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 0.0960 -1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -0.1480 -2.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 0.4210 -4.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 1.2320 -4.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3270 1.4890 -2.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9210 0.9090 -1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5590 2.3660 -2.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1880 2.5540 -1.9070 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0200 -2.8520 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -3.1330 1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 -3.2880 2.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -4.5960 3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -5.6590 3.5740 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 -2.1790 3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -1.7850 4.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 -0.7350 4.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 -0.0780 3.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 -0.4640 2.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 -1.5150 2.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3130 1.2180 4.5370 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 2.2560 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6590 1.8310 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 2.0240 1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -0.4380 2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 -0.7390 -2.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 0.2430 -4.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 1.6730 -5.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5380 1.0760 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 -2.7050 -1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 -2.8650 -1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 -3.8470 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -4.0300 1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -2.2830 5.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 -0.4370 5.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0100 0.0460 1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5920 -1.8070 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8690 2.8490 -4.1290 O 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 43 2 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 3 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M CHG 1 14 -1 M END