NCID-ZINC04990522 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 61 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0200 -0.6140 1.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6690 -1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.1190 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.6960 -2.5130 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8380 -2.2990 -3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -4.2220 -2.4420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7410 -4.6170 -1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -4.7960 -3.8620 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8910 -4.4400 -4.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -4.3320 -4.5380 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2820 -4.6900 -5.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -2.8020 -4.5270 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4770 -2.4060 -5.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -2.3330 -3.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8740 -2.2440 -5.2630 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -0.4410 -5.3020 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7700 -0.1820 -5.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 0.1820 -6.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7270 1.7030 -6.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 2.2400 -4.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 1.6170 -3.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6110 0.0960 -3.8710 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7560 -0.3480 -3.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 -0.3700 -2.9100 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 -4.8620 -3.8150 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5150 -5.1050 -4.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5330 -4.8820 -5.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7410 -5.6560 -3.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -6.2460 -3.8000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 -6.8910 -4.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -6.2630 -5.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -8.3960 -4.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 -4.5940 -1.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -4.7370 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -4.5570 0.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6080 -5.1220 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -2.4460 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -2.4700 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8010 -0.0760 -5.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9380 -0.2000 -7.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5820 2.1470 -6.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8110 1.9620 -6.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5680 1.9810 -4.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5390 3.3230 -4.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 1.9990 -2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 1.8750 -4.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5360 -5.7910 -2.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0030 -6.6160 -4.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5700 -4.9590 -3.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 -8.7240 -4.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -8.7570 -5.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -8.7980 -4.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 -6.0880 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4110 -5.1900 1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3730 -4.3680 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 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 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 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 10 1 0 0 0 0 8 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 31 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 27 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 55 1 0 0 0 0 34 56 1 0 0 0 0 34 57 1 0 0 0 0 35 36 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 38 58 1 0 0 0 0 38 59 1 0 0 0 0 38 60 1 0 0 0 0 M END