PUBCHEM-ZINC02860590 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 0.1160 0.9760 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 1.0360 2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 1.4970 3.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5330 3.3880 2.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 2.9270 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5490 3.4480 4.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 4.9520 5.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 5.5570 4.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 5.6250 6.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 7.0010 6.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 7.6060 5.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 8.9690 5.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 9.7460 6.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 9.1640 6.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 7.7840 6.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 7.1550 7.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1100 7.0610 8.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0760 6.6390 6.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1590 5.9480 7.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1550 5.4700 6.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0830 5.6720 4.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0120 6.3560 4.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0120 6.8450 5.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 11.6130 6.5240 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -0.1130 0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 1.3710 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 1.3080 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 1.4780 2.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -0.0500 2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 1.0340 3.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 1.2050 4.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 4.4750 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5290 2.9470 2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 3.2190 0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 3.3910 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 3.0270 5.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5950 3.1450 4.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 5.1510 6.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 7.0080 5.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 9.4350 5.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3360 9.7720 7.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2170 5.7890 8.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9940 4.9350 6.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8650 5.2940 4.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9610 6.5100 3.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1790 7.3830 4.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 1.4650 1.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 2.9590 3.7670 N 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 47 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 48 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 48 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 47 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 6 48 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 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 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 M END