OTAVA-ZINC06167288 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 69 0 0 1 0 0 0 0 0999 V2000 1.2530 2.9300 -1.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 1.4680 -1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5420 0.6160 -2.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -0.7130 -2.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -1.1470 -1.4830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 -1.6310 -3.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -2.0470 -4.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -2.8910 -5.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 -3.2070 -4.5100 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1860 -2.1860 -3.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0210 -1.9510 -2.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2280 -2.5470 -2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5840 -3.2910 -2.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1170 -2.2970 -0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3700 -2.9140 -0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1960 -2.6780 0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7870 -1.8270 1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 -1.2120 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7120 -1.4380 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6040 -1.5980 2.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9150 -2.1640 2.2520 C 0 0 3 0 0 0 0 0 0 0 0 0 10.2750 -2.1420 1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8670 -3.6110 2.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8460 -1.3650 3.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4110 -0.4620 3.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1620 -1.6540 3.1520 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0090 -0.9880 4.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5360 -0.5930 5.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3740 0.0640 6.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6840 0.3310 5.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1570 -0.0600 4.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3260 -0.7240 3.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8280 1.2320 7.0150 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 -3.4880 -6.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -1.5870 -4.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 -0.8030 -6.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 -0.3770 -6.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 -0.7270 -5.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 -1.5040 -4.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -1.9410 -4.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 3.0660 -1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 3.1970 -2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 3.5690 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 1.2010 -0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 1.3310 -1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 -1.3580 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6880 -3.5750 -1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1640 -3.1540 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2270 -0.5530 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7460 -0.9560 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8670 -4.0430 2.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5070 -3.6330 3.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1940 -4.1890 2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5230 -2.3250 2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5140 -0.8010 5.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0070 0.3710 7.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1800 0.1500 4.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6970 -1.0340 2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -2.8350 -7.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -4.4680 -6.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 -3.5910 -6.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -0.5290 -6.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 0.2300 -7.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5570 -0.3910 -6.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2950 -1.7730 -4.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 -2.5520 -3.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 44 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 30 31 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 58 1 0 0 0 0 34 59 1 0 0 0 0 34 60 1 0 0 0 0 34 61 1 0 0 0 0 35 36 1 0 0 0 0 35 40 2 0 0 0 0 36 37 2 0 0 0 0 36 62 1 0 0 0 0 37 38 1 0 0 0 0 37 63 1 0 0 0 0 38 39 2 0 0 0 0 38 64 1 0 0 0 0 39 40 1 0 0 0 0 39 65 1 0 0 0 0 40 66 1 0 0 0 0 M END