IBS-ZINC01148867 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.7430 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6960 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 0.0040 -2.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.6840 -3.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -2.0660 -3.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.7660 -2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -2.0850 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -2.8130 -4.9240 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3390 -2.1680 -5.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -3.3650 -5.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -4.8630 -5.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -5.1400 -5.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -4.0200 -4.8340 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 -4.0450 -4.5200 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9320 -5.1860 -5.2200 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 -2.7380 -4.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -4.3060 -2.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2710 -5.8540 -5.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9670 -7.2180 -5.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9620 -8.1390 -5.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2600 -7.7160 -6.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5690 -6.3670 -6.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5840 -5.4350 -5.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6190 -8.9880 -6.3820 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.0400 2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 -1.3820 1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -1.3580 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 1.0830 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -0.1400 -4.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -3.8460 -2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -2.6310 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 -3.0980 -4.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 -2.9950 -6.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -5.2490 -2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 -4.3350 -2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0660 -3.4880 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -7.5490 -5.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 -9.1940 -5.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5830 -6.0430 -6.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 -4.3820 -5.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 M END