SPECS-ZINC04667069 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8480 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 -2.6800 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -4.0510 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -4.5960 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 -3.7710 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 -2.3980 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2900 -1.2690 0.0490 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 -5.1070 -0.0330 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -6.3450 -0.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 -4.3440 -0.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -5.4090 1.5430 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -6.4700 2.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -7.4780 1.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -8.4460 2.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -8.4270 4.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -7.4340 4.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -6.4610 3.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2370 -5.2810 3.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 -4.6040 2.3380 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8290 -3.5820 2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 -4.6120 1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -2.2550 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 -5.6690 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9240 -4.1990 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -7.4980 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -9.2220 2.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 -9.1870 4.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 -7.4180 5.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 -4.5980 4.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2490 -5.6200 3.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5260 -4.1970 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2670 -4.0100 2.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 -5.6370 1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 22 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 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 M END