PUBCHEM-ZINC02915726 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 70 0 0 1 0 0 0 0 0999 V2000 -0.5840 1.0590 2.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -0.0140 1.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -0.7040 1.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 -1.6680 0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -1.9830 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 -2.2840 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 -3.6110 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1830 -4.1980 0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2270 -3.4600 0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2340 -2.1240 0.4680 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4550 -1.5570 0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6480 -0.4020 1.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5330 -2.5640 0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8110 -2.2250 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9270 -3.0940 0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2560 -2.8730 0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0040 -4.0190 0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1090 -4.8980 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8680 -4.3380 0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1900 -6.2300 -0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3990 -6.9370 -0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4570 -8.2160 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3100 -8.8070 -1.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0970 -8.1200 -1.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0490 -6.8380 -1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8390 -8.6900 -2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5740 -8.4020 -3.4390 O 0 5 0 0 0 0 0 0 0 0 0 0 -11.4530 -10.3840 -2.3950 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.8470 -4.0760 0.1180 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 -1.3550 0.4320 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0080 -0.7470 1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9760 -0.4300 -0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8330 0.9490 -0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8060 1.8050 -1.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9220 1.3330 -3.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0640 -0.0580 -3.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0890 -0.9250 -2.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 2.1880 -4.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6910 3.6210 -3.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0810 1.6820 -5.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 -4.5850 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 1.6160 3.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 1.7590 2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 0.6140 3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 0.4480 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -0.7220 2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0400 -1.2090 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6400 -1.9780 1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0660 -4.1730 0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3090 -6.5080 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4060 -8.7460 -1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0910 -6.3190 -1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 1.3820 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6970 2.8670 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 -0.5130 -4.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1980 -1.9930 -2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7370 3.8220 -3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6570 4.1450 -4.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5070 4.0680 -3.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0430 1.1680 -5.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0760 2.4870 -6.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2710 0.9950 -5.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 -4.2840 0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 -5.5710 0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -4.7000 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1320 -9.3730 -1.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 45 1 0 0 0 0 2 46 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 41 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 47 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 48 1 0 0 0 0 17 18 2 0 0 0 0 17 49 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 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 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 52 1 0 0 0 0 26 27 1 0 0 0 0 26 66 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 53 1 0 0 0 0 34 35 1 0 0 0 0 34 54 1 0 0 0 0 35 36 2 0 0 0 0 35 38 1 0 0 0 0 36 37 1 0 0 0 0 36 55 1 0 0 0 0 37 56 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 39 57 1 0 0 0 0 39 58 1 0 0 0 0 39 59 1 0 0 0 0 40 60 1 0 0 0 0 40 61 1 0 0 0 0 40 62 1 0 0 0 0 41 63 1 0 0 0 0 41 64 1 0 0 0 0 41 65 1 0 0 0 0 M CHG 1 27 -1 M END