OTAVA-ZINC06143915 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.0670 1.0470 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 0.9230 2.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 2.9260 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 3.4280 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 4.8870 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 5.8530 -0.6290 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9580 5.7200 -1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 7.2220 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 7.0300 0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8700 5.5790 0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8000 5.0840 1.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4160 8.0100 0.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 8.5120 -0.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 9.2560 0.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 8.9080 -2.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 10.0820 -2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 10.4470 -3.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 9.6520 -4.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 8.4840 -4.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 8.1080 -3.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 10.0160 -6.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 9.1530 -6.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 5.6780 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 5.6020 -0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 5.4420 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9450 5.3590 0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 5.4350 1.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 5.6000 1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6820 5.1400 1.7020 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -0.0410 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 1.4140 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 1.4610 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 1.3430 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -0.1620 2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 1.1860 3.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 3.3690 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 3.2110 2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 3.1430 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7840 2.9850 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1780 7.6860 1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 10.7010 -1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 11.3540 -4.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 7.8680 -5.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0190 7.1990 -2.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 8.1630 -6.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 9.0780 -6.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 9.5590 -8.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 5.6670 -1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 5.3820 -1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 5.3690 2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 5.6640 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 1.4630 1.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 52 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 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 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 M END