PUBCHEM-ZINC03661653 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 0.1460 1.4890 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 0.0080 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -0.6960 1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 -2.0760 1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -2.7270 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 -2.0210 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 -0.6570 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 0.2170 -2.6780 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 -2.7370 -2.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -4.1820 -0.0070 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0500 -4.5900 0.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -4.9720 -0.0970 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0760 0.0060 2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -0.6540 3.6130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 0.0130 4.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 1.1520 5.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 1.8240 6.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 1.3770 7.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 0.2510 6.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 -0.4460 5.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 -1.6500 5.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 -2.2500 4.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 2.0500 8.3900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 1.6600 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 1.9500 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 1.9300 0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 -2.7230 -2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 -2.2370 -3.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -3.7700 -2.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 1.0680 2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 1.5070 4.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 2.7050 6.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -0.0910 7.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 1.7400 9.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 -2.7690 2.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -2.0850 6.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2150 -2.8790 6.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 -2.8100 2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 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 35 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 23 34 1 0 0 0 0 35 38 1 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 10 1 M CHG 1 12 -1 M END