IBS-ZINC05205733 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 1 0 0 0 0 0999 V2000 1.0130 2.1970 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 0.8010 -0.0410 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9860 0.4340 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 -0.1510 1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 0.2600 2.2710 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 0.4670 2.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6700 1.3890 0.8320 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3030 2.3860 1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 0.8640 -0.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1500 1.4680 0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 0.4420 3.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 0.2610 3.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 0.8580 4.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 1.5780 5.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 1.7670 6.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 2.4180 7.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 2.4320 8.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5490 1.8040 7.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4030 1.1570 6.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 1.1300 5.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 0.5850 4.7510 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 0.0890 4.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6770 3.2400 9.8880 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 2.1480 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 2.8740 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 2.5630 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -1.1710 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 -0.0980 1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9810 -0.4910 1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 0.9300 2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7190 1.8640 1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2710 2.1240 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 0.4710 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 1.9400 5.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 2.9080 8.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5150 1.8230 8.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2510 0.6720 6.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 2 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 20 21 1 0 0 0 0 21 22 1 0 0 0 0 M END