PUBCHEM-ZINC01213264 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 2.5400 -1.3750 2.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3040 -1.1650 1.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 -2.2180 0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 -3.2840 1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 -2.0780 -0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 -0.8540 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 -0.7260 -2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 -1.8060 -3.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -3.0280 -2.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 -3.1660 -1.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -4.1180 -3.8040 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -5.3700 -3.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 -5.5480 -2.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -6.5210 -4.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0810 -6.3230 -5.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 -7.4610 -6.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 -8.5960 -6.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6230 -9.6580 -7.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5930 -9.6040 -8.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3970 -8.4840 -8.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -7.4110 -7.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4320 -8.4370 -9.2790 N 0 3 0 0 0 0 0 0 0 0 0 0 5.5750 -9.3820 -10.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1400 -7.4530 -9.3940 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3140 -7.8200 -3.7670 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -8.1860 -3.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -7.4120 -3.5530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -9.5280 -2.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -10.3740 -2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -11.6250 -2.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -12.0430 -1.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -11.2110 -2.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -9.9530 -2.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 -8.9060 -2.9040 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.8750 -2.1570 3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 -1.6760 3.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 -0.4500 3.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 -0.0080 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 0.2220 -3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7030 -1.6990 -4.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 -4.1140 -1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -3.9720 -4.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3700 -5.3300 -5.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6930 -8.6400 -5.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -10.5350 -7.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 -10.4390 -8.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8570 -6.5360 -7.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 -8.4580 -3.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9130 -10.0500 -2.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 -12.2810 -1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -13.0240 -1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 -11.5430 -1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 32 2 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 33 34 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END