PUBCHEM-ZINC02867596 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 0.0050 1.0640 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 1.0870 2.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 1.4750 3.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 2.9960 3.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 3.4470 2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 3.0020 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8260 3.3680 4.8550 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 4.6000 5.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 5.4030 4.9240 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 4.9760 6.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 4.1260 7.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3260 4.5240 8.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1540 5.6830 8.7290 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2310 6.5610 8.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 6.2560 7.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 7.1770 6.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 8.3590 7.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 8.6610 8.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 7.7930 8.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3760 3.6060 8.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1620 3.9750 9.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1370 3.1170 10.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3370 1.8930 9.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5600 1.5220 8.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5850 2.3750 8.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8390 -0.1530 7.6620 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.0250 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 1.4520 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.4140 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 1.5570 2.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 0.0040 2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 0.9940 3.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 1.1520 4.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 3.4760 3.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 2.9970 2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 4.5330 2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 3.3090 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 3.4630 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 2.7270 5.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7200 3.1680 6.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 6.9530 5.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 9.0690 7.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 9.6030 9.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6980 8.0430 9.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0070 4.9290 10.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7460 3.4020 11.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1010 1.2250 9.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9830 2.0870 7.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 1.5400 1.2350 N 0 0 0 0 0 0 0 0 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 1 49 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 6 49 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 41 1 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 44 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 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 48 1 0 0 0 0 M END