PUBCHEM-ZINC05896119 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3770 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 1.2160 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 0.0350 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4160 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.5660 0.0100 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0820 4.1570 0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 4.1920 0.0040 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2450 -2.4420 -0.0220 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 -2.8110 -0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1990 -4.2620 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 -4.5480 -0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8850 -6.0360 -0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3830 -6.7730 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4510 -8.0870 0.1830 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7780 -8.8090 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9860 -8.2320 -1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6060 -6.9550 -1.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0860 -6.7930 -2.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9460 -7.8940 -3.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 -9.1570 -3.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8410 -9.3270 -1.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 -7.7420 -4.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9030 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 -0.4870 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 1.9730 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 -2.3760 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0020 -4.6680 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 -4.7310 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8480 -4.1420 -1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3190 -4.0800 0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6850 -6.3850 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7960 -5.8140 -3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2060 -10.0120 -3.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1260 -10.3120 -1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1090 -7.5680 -5.5930 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 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 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END