NCID-ZINC05478982 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 55 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 1.5850 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 1.8000 -2.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 1.8160 -1.1600 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5060 2.1800 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 0.5010 -1.4420 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6170 0.0920 -2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4440 0.7550 -1.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1410 0.4660 -2.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5020 0.6990 -2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1670 1.2220 -1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4690 1.5110 -0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1080 1.2720 -0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3020 2.1670 0.8960 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -8.8760 1.5150 -1.7190 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.6100 -0.6820 -0.1120 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4200 -2.1980 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2140 -3.3120 0.3370 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6470 -3.0100 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8870 -4.5710 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 -5.4440 -0.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6170 2.8380 -2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 2.4790 -3.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5230 4.3080 -1.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 5.1230 -3.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8590 6.8920 -2.7100 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4210 7.6790 -4.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3840 9.2000 -4.0820 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3640 9.5170 -3.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8510 9.8540 -5.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9830 10.2660 -5.4450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.4370 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6230 0.0580 -3.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0460 0.4730 -3.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5630 1.4940 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4870 -2.0140 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 -2.5000 -1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -3.8410 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1680 4.5370 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 4.5610 -1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 4.8930 -3.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0020 4.8690 -3.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7650 7.3860 -5.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4400 7.3620 -4.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2110 10.5880 -2.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2120 -4.7240 0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 -3.5600 0.5090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -2.7490 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0090 9.9780 -6.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2670 9.5950 -2.9760 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2190 9.3120 -3.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3540 10.4040 -7.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5990 -5.5490 -0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 22 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 16 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 37 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 49 1 0 0 0 0 20 21 2 0 0 0 0 20 48 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 52 1 0 0 0 0 30 31 2 0 0 0 0 30 51 1 0 0 0 0 40 49 1 0 0 0 0 47 52 1 0 0 0 0 48 55 1 0 0 0 0 49 50 1 0 0 0 0 51 54 1 0 0 0 0 52 53 1 0 0 0 0 M END