PUBCHEM-ZINC03687403 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 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 -1.8490 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -2.6800 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 -4.0500 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -4.6170 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 -3.7810 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -2.3910 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0900 -4.6640 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 -5.9400 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -5.9220 -0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 -6.7080 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 -7.1530 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 -8.2330 -0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1750 -9.2490 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1100 -9.0110 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8520 -7.4230 1.0400 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.4960 -10.2040 0.8080 Br 0 0 0 0 0 0 0 0 0 0 0 0 -5.5360 -4.2420 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0400 -4.0900 -1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5090 -3.6610 -1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0130 -3.5100 -2.8230 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 0.6080 -2.2460 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -4.6840 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 -1.7460 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 -8.2960 -1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1390 -10.1700 -1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1300 -4.9970 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6300 -3.2890 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4470 -3.3350 -1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9460 -5.0430 -1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1020 -4.4170 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6030 -2.7080 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4190 -2.7540 -3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9190 -4.4630 -3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5450 -2.2500 -2.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4230 -3.0980 -2.8070 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7790 -2.9910 -3.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 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 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 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 19 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 43 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 M END