OTAVA-ZINC00751877 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.2360 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -0.2910 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -0.7180 1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -0.2960 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -0.0180 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 0.3490 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3210 0.7300 -0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5140 1.0130 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6240 0.9190 1.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5580 0.5420 2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3540 0.2550 1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1640 -0.1290 2.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6310 1.3990 -0.6030 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5380 2.7000 -0.1250 S 0 0 0 0 0 0 0 0 0 0 0 0 8.8720 2.4770 1.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5110 2.9040 -1.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4830 4.1110 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8460 4.5220 1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0190 5.6290 0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8290 6.3250 -0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4660 5.9140 -1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2970 4.8100 -1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6970 7.8400 -0.2330 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 -0.1180 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 0.3120 -2.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -0.7970 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -0.8730 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 1.6540 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 1.5430 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 1.5980 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 -0.2420 2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -1.8010 1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2360 0.8020 -1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5710 1.1480 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6570 0.4740 3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8730 0.9060 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9950 3.9770 1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5220 5.9500 1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3170 6.4570 -2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7980 4.4910 -2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -1.8770 -1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -0.5470 -2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -0.5630 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -1.9610 0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -0.5080 0.9900 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 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 M END