CHEMBRIDGE-ZINC02177953 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 53 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -3.9960 2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 -4.4570 3.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 -4.6850 4.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -5.1090 5.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 -5.3040 5.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 -5.0740 4.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 -4.6560 3.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 -5.3370 4.6990 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -5.7190 7.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4040 -7.1290 7.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1640 -7.3980 8.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5520 -6.4720 9.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4120 -8.6660 8.8970 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1510 -8.9270 10.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3900 -8.3260 11.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2950 -10.4370 10.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5390 -8.2890 10.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 -5.3330 7.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -5.1110 7.1150 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 -1.0200 -0.3810 0.0100 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 -4.3610 1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -4.3860 2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -4.5330 4.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 -4.4800 2.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4150 -7.5840 7.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 -7.5570 6.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1020 -9.4060 8.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4010 -8.7800 11.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9390 -8.5200 12.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2870 -7.2500 11.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8370 -10.8640 9.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8440 -10.6310 11.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3060 -10.8910 10.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4360 -7.2140 9.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0880 -8.4830 10.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0810 -8.7170 9.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 -5.3260 8.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -4.0720 6.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -5.7670 6.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -2.5270 2.4230 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 -2.1400 2.4730 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 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 52 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 52 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 35 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 52 53 1 0 0 0 0 M END