PUBCHEM-ZINC05562378 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3060 0.0090 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 -1.2930 -0.7750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -1.7000 -1.1260 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8590 -2.9790 -1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 -3.7730 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -5.0670 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 -5.5900 -1.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 -4.8190 -2.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -3.5140 -2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 -2.5050 -3.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -1.4210 -2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 -0.2120 -2.6860 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 -2.5890 -4.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -3.0790 -4.6250 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1460 -2.4300 -4.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9630 -3.0480 -6.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6540 -1.9520 -6.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0740 -1.9220 -7.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8030 -2.9900 -8.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1110 -4.0880 -8.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6870 -4.1140 -6.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 -5.4290 -9.2620 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 -2.9540 -10.3490 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 -4.4170 -4.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8580 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8330 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -0.5310 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -1.3390 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -0.0810 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -3.3720 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -5.6800 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -6.6070 -1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -5.2320 -3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3980 0.5120 -2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -0.0860 -3.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9820 -1.6040 -4.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -3.2870 -5.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8660 -1.1180 -5.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6140 -1.0650 -8.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1430 -4.9680 -6.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0410 -5.0500 -4.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 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 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 12 2 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 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 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 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 25 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 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 23 1 0 0 0 0 22 41 1 0 0 0 0 25 42 1 0 0 0 0 M CHG 1 4 1 M END