PUBCHEM-ZINC02921131 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 62 0 0 1 0 0 0 0 0999 V2000 0.4850 -2.5400 -2.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -1.9210 -1.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -2.3360 -1.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -1.8360 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 -1.0900 0.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 -2.2630 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5190 -3.5570 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8340 -3.9400 0.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7080 -3.0100 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4770 -1.6660 0.4620 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5280 -0.8480 0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4940 0.3730 0.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7410 -1.6640 1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8880 -1.0710 1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1170 -1.7440 1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2950 -1.2210 2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2520 -2.2660 2.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6290 -3.3900 1.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3510 -3.0710 1.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.0150 -4.7790 1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2800 -5.2530 1.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6330 -6.5900 1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7270 -7.4730 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4630 -7.0200 0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1190 -5.6780 0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4510 -7.9060 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4370 -7.9210 -1.1870 O 0 5 0 0 0 0 0 0 0 0 0 0 -13.2280 -9.1060 0.8440 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -7.3760 -3.3350 0.8620 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.1760 -1.1420 0.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9020 -0.4320 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2600 -0.4430 -1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8010 -1.1360 -2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8820 -0.5410 -3.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4180 0.7560 -3.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8720 1.4580 -2.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7910 0.8660 -1.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 1.8160 -0.2570 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.5330 -4.6990 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -2.2520 -3.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -3.6330 -2.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -2.2240 -3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -2.2620 -0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -0.8280 -1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9070 0.0120 1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4440 -0.1940 2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2690 -2.1970 2.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0080 -4.5950 2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6210 -6.9350 1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1260 -5.3470 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1640 -2.1570 -2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3060 -1.0950 -4.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4800 1.2210 -4.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5090 2.4710 -2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7900 -5.4070 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -5.2330 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -4.3820 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6720 -8.5250 0.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 43 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 30 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 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 58 2 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 51 1 0 0 0 0 34 35 1 0 0 0 0 34 52 1 0 0 0 0 35 36 2 0 0 0 0 35 53 1 0 0 0 0 36 37 1 0 0 0 0 36 54 1 0 0 0 0 37 38 1 0 0 0 0 39 55 1 0 0 0 0 39 56 1 0 0 0 0 39 57 1 0 0 0 0 M CHG 1 27 -1 M END