PUBCHEM-ZINC04713103 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7090 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.1050 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.7060 -0.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -1.9930 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6670 -1.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.6950 -2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -4.0880 -2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -4.7370 -3.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -4.0070 -4.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -2.6240 -4.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -1.9650 -3.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -4.9030 -6.5740 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -2.8530 2.3050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -4.2520 2.2400 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -4.9520 3.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -6.4250 3.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -7.1930 4.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -8.5710 4.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -9.1420 3.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -8.3940 1.9690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -7.0790 2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.1920 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -4.6590 -1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -5.8170 -3.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -2.0590 -5.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.8860 -3.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -2.4070 3.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -4.4560 4.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -6.7210 5.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -9.1950 5.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -10.2180 2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -6.5010 1.1180 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 15 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 33 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 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 23 37 1 0 0 0 0 M END