PUBCHEM-ZINC03662287 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 0 0 0 0 0 0999 V2000 -0.7600 1.4060 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 0.1030 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -0.2750 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 -1.4660 1.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 -2.2790 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -1.9190 -0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -0.7390 -1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -0.3040 -2.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -1.0110 -3.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 -2.6750 -3.7710 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 -0.1870 -4.8580 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -0.7610 -6.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -0.9180 -6.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 -1.5900 -8.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5530 -2.9100 -9.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9470 -3.2390 -10.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6630 -1.9950 -11.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6850 -0.8960 -9.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2870 -0.5780 -9.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0790 -2.3370 -11.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 1.2850 -4.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 1.8770 -4.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 2.0360 -5.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1270 2.6750 -4.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 2.8680 -3.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 2.3890 -3.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 -3.7330 0.6670 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 2.1540 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 1.2680 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 1.8030 0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 0.3610 2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -1.7430 2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -2.5500 -1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 0.6990 -2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -0.1030 -6.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -1.7230 -6.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 -1.5100 -6.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 0.0680 -6.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -0.9880 -8.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -2.5670 -8.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 -3.7960 -9.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -2.5330 -10.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8670 -3.9920 -11.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5360 -3.6920 -9.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 -1.6220 -11.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1300 0.0160 -10.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3200 -1.2030 -9.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 -0.1850 -10.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3480 0.1480 -8.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6860 -2.7170 -10.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5800 -1.4530 -11.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0600 -3.1030 -12.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 1.6590 -5.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 1.5760 -4.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 1.7240 -6.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1550 2.9590 -4.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 3.3070 -2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6430 -1.8380 -8.8860 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.2540 -2.2110 -8.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 58 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 58 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 19 58 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 55 1 0 0 0 0 24 25 2 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END