PUBCHEM-ZINC06694225 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 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 -0.6960 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0940 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7820 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0690 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6870 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.9880 -2.8770 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.1390 -0.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.8400 2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -4.1430 2.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -4.8370 3.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -4.4430 4.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 -5.1420 5.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -6.2330 6.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 -6.6380 5.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 -5.9340 3.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -7.8070 5.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 -8.5670 6.3420 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -8.4370 7.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 -9.5540 6.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 -10.6020 6.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0490 -11.4340 6.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5370 -11.2300 5.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0670 -10.2040 4.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 -9.3470 4.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 -8.2670 4.3210 N 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 0.0250 -0.1600 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1360 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 -4.5440 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -2.3070 3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 -3.5910 4.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 -4.8340 6.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -6.7760 6.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -6.2400 3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 -10.7650 7.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4300 -12.2500 6.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2960 -11.8900 4.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 -10.0560 3.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 27 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 M END