PUBCHEM-ZINC04213985 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 0 0 1 0 0 0 0 0999 V2000 -0.3150 1.3720 0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 0.2630 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 -0.4330 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 -0.0210 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 1.0890 1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 1.7850 1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 2.9720 2.3870 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2230 3.5860 2.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 3.3360 2.9470 O 0 5 0 0 0 0 0 0 0 0 0 0 3.3280 -0.7810 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1470 -0.1100 -0.8200 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2490 0.9530 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5130 -0.7420 -0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7530 -1.5740 -1.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -1.6430 -1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -3.0470 0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.0700 1.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -4.3680 2.6140 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 -4.0380 -1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 -4.0370 -1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0400 -5.4310 -2.5980 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 1.9190 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 -0.0590 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 1.4110 1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9010 -0.7820 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 -1.8070 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3960 -1.2580 -2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -1.6740 -1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7750 -1.5850 -1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 -3.4070 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 -2.0960 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 -5.0040 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 -3.6860 2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -4.0080 -1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -4.9420 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9620 -3.1060 -2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 -4.1240 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4640 -0.3820 -0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 -0.2810 -2.1090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5530 0.1530 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -2.8590 -0.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3240 -0.8160 -0.0930 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 39 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 27 39 1 0 0 0 0 38 42 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END