PUBCHEM-ZINC02169508 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 0.0640 0.9050 1.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 -0.0110 0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -0.4800 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -0.0360 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 0.8880 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 1.3550 1.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2650 -0.5350 -0.8390 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2150 0.4210 -1.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8380 1.7470 -1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7610 2.6710 -2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0790 2.2880 -2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4740 0.9820 -2.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5500 0.0580 -1.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4010 -1.9150 -1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1470 -2.4010 -1.9550 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 -2.7120 -0.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 -4.0880 -0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0180 -4.5930 0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 -5.9720 0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 -6.8680 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -6.3480 -0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 -4.9660 -0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -4.4660 -1.4760 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3510 -5.0320 -1.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -3.5120 -2.2620 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5780 -8.3590 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 -9.0960 -0.8600 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7550 1.2670 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -0.3560 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -1.1760 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 1.2360 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 2.0640 2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8100 2.0780 -1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4460 3.6880 -2.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7960 3.0030 -2.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5040 0.6790 -2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9110 -0.9450 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7410 -3.9270 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1550 -6.3600 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 -7.0330 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6290 -8.7580 0.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 14 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 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 26 41 2 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M CHG 1 27 -1 M END