PUBCHEM-ZINC04551224 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 0 0 0 0 0 0999 V2000 4.7440 1.5250 3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7920 0.1460 3.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4370 -0.5850 2.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0330 0.0830 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 1.4690 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3440 2.1870 2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 2.1430 0.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 3.5340 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1930 4.1140 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 5.4890 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1930 6.2890 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4490 5.7150 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5820 4.3400 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9270 3.7270 -0.0940 N 0 3 0 0 0 0 0 0 0 0 0 0 6.9210 4.4290 -0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0400 2.5210 -0.2230 O 0 5 0 0 0 0 0 0 0 0 0 0 3.0540 7.7620 0.0900 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9490 8.2690 0.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0450 8.4680 0.0290 O 0 5 0 0 0 0 0 0 0 0 0 0 4.4860 -2.0160 2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5260 -3.1510 2.4060 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 2.0890 4.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 -0.3670 4.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 -0.4770 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3080 3.2670 2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3960 1.6460 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 3.4900 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 5.9400 0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3260 6.3430 -0.0610 H 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 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 27 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 3 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M CHG 1 17 1 M CHG 1 19 -1 M END