NIH-ZINC06191413 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 0.3820 1.6830 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 1.5390 1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 0.5780 1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 -0.2450 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 -0.1060 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 0.8670 -1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 -0.9830 -2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 -1.7460 -2.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 -1.4680 -0.0510 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 -1.2810 1.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 -2.6960 -0.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 -1.1040 -1.3160 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3970 0.1570 -1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4970 0.0960 -2.3810 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1230 -0.7790 -2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3550 1.3600 -2.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4500 1.2520 -3.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3150 2.2990 -3.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4000 2.2600 -4.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2780 3.3260 -4.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0750 4.4310 -3.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9930 4.4720 -2.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1090 3.4110 -2.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2790 5.8880 -3.4460 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.9030 0.0040 -3.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 2.4320 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 2.1810 1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 0.4720 1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 0.9790 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7460 -1.7260 -2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7190 0.9800 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8470 0.3160 -0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7480 2.2280 -2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7360 1.4770 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5600 1.3980 -4.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1240 3.2960 -4.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8360 5.3350 -1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2620 3.4450 -1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3310 0.7520 -3.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -0.9360 -3.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -1.5290 -4.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 25 39 1 0 0 0 0 40 41 1 0 0 0 0 M END