IBS-ZINC05453869 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3830 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 1.2000 -0.6870 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 0.0190 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 1.4250 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 2.0960 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 1.8450 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 0.8040 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7270 -0.3520 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2490 -1.7210 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4140 -2.1830 -1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6090 -1.9690 -2.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7610 -2.3930 -3.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 -3.0320 -4.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 -3.2460 -3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 -2.8270 -2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9090 -3.5640 -5.7270 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 0.8670 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5550 2.0670 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0150 2.1310 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7700 3.2710 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1150 2.8650 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1230 1.5150 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8550 1.0750 -0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5530 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -1.7670 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 3.1760 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2140 -1.7460 0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5510 -2.3800 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4230 -1.4690 -1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6950 -2.2240 -3.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 -3.7460 -3.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 -2.9980 -1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5100 -0.0430 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 2.9780 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4040 4.2870 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9800 3.5110 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0040 0.8910 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 M END