IBS-ZINC05206961 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0910 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7480 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.9650 -0.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.0130 -1.2160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6700 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0400 -2.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -2.6890 -2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.5090 2.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -1.4010 3.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.3380 2.4830 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -3.8960 2.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 -4.3990 2.9850 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0070 -4.2670 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -5.8780 3.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 -5.9120 4.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1710 -4.6960 4.5740 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 -3.7430 4.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 -7.1250 4.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 -8.3870 4.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7830 -9.5170 4.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9220 -9.4040 5.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3860 -8.1560 5.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 -7.0160 5.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 -5.4520 5.9720 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.7700 -10.8320 6.0240 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 -2.8710 -2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -2.0600 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -3.6390 -2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -1.3910 4.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 -3.9440 3.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -4.5200 2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -6.1390 4.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -6.5410 2.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 -8.4780 3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4260 -10.4940 4.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2740 -8.0740 6.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 M END