PUBCHEM-ZINC05500488 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3150 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -0.6850 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 -0.4610 -0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2420 -1.3370 -0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 -2.0820 0.4890 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 -1.7020 0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -2.2710 1.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -3.2740 2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -3.8450 3.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -4.8860 4.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -5.4160 5.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -4.9180 5.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 -3.8780 4.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -3.3430 3.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -5.4920 6.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -6.3960 7.5490 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 -5.0120 7.1070 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9320 -5.5810 8.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2820 -4.8640 8.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0120 -5.1270 7.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 0.5510 -1.9450 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3730 1.2850 -2.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3230 0.6490 -2.6360 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9120 1.8670 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8420 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 -1.4220 -1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 -1.8860 2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 -3.6580 2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 -5.2710 4.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -6.2200 6.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5690 -3.4950 5.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -2.5360 3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4740 -4.2910 6.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0920 -6.6430 7.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4120 -5.4540 9.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8490 -5.2250 9.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1190 -3.7900 8.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8800 -4.7020 7.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 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 31 1 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 34 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 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END