PUBCHEM-ZINC02475941 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 56 0 0 0 0 0 0 0 0999 V2000 0.0620 -0.1480 -1.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -1.4980 -1.3770 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -1.6690 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.9620 0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -4.0530 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -5.1940 0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -3.8240 -1.7040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.5700 -2.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -2.4020 -3.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -4.9570 -2.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -2.8320 1.8940 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -1.5000 2.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -0.8260 1.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -0.9420 3.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 0.5100 3.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 0.8600 5.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 1.1100 5.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 1.4310 7.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 1.5030 7.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 1.2520 7.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 0.9360 5.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 1.3850 8.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 2.1180 9.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 1.7940 9.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -3.9210 2.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -4.3630 3.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 -5.1840 2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 -5.5890 2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9870 -5.1730 3.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3510 -4.3530 4.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -3.9510 4.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -2.8340 5.5120 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 0.1710 -2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 -0.1510 -2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 0.5400 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 -5.2230 -2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -4.6830 -3.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -5.8100 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -1.5110 4.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 0.9910 3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 0.8580 3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 1.0530 5.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 1.6260 7.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 0.7440 5.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6660 3.1890 9.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9250 1.7850 10.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -4.7610 2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -3.5730 3.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -5.5080 1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8170 -6.2300 1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0040 -5.4900 3.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8720 -4.0280 5.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 M END