IBS-ZINC02247074 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3900 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 1.1780 -0.6880 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0150 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4320 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 2.1040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 2.1250 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6720 1.4800 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0850 1.8920 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8370 0.7220 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0210 -0.3670 -0.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6950 0.0150 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 -0.6500 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4550 -1.6620 -0.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2060 0.6720 -0.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5970 3.2600 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8210 3.8250 1.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8220 3.8970 -1.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3360 5.2690 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4990 5.7470 -2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4520 6.3860 -3.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6000 6.8240 -4.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7970 6.6230 -5.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8440 5.9840 -4.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6960 5.5510 -3.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9840 7.1730 -6.8690 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 1.9100 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.5490 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -1.7680 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 3.1840 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5790 -2.0110 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8240 -2.2510 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7210 1.4940 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6600 -0.1850 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6440 3.4470 -2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6350 5.9190 -0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3020 5.2950 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5180 6.5420 -2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7820 7.3220 -5.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7790 5.8270 -5.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5150 5.0560 -2.7880 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 13 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 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 19 37 1 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 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 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 40 1 0 0 0 0 25 41 1 0 0 0 0 M END