PUBCHEM-ZINC04521034 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3820 0.0100 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 1.1980 -0.6890 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0100 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4120 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 1.8510 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3990 3.0990 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7920 3.1820 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5610 2.0100 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9600 0.7860 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5690 0.6830 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7210 -0.4060 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1560 -1.8050 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 -2.2840 -1.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7200 -3.6490 -1.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4040 4.4020 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6920 4.4780 -0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3050 5.6990 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7000 5.7850 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3120 7.0210 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5480 8.1750 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1660 8.0980 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5400 6.8690 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2120 9.4980 -0.0480 N 0 3 0 0 0 0 0 0 0 0 0 0 11.4280 9.5690 -0.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5420 10.5150 -0.0370 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -1.7690 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8010 3.9980 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6390 2.0770 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5640 -0.1090 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1180 -1.8900 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4180 -2.4190 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3330 -2.1990 -1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0330 -1.6700 -2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8290 -4.0190 -2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2970 4.8850 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3890 7.0890 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5760 9.0030 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4620 6.8100 -0.0360 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 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 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END