PUBCHEM-ZINC03107479 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3750 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 1.2080 -0.6830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0140 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 1.3930 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 3.5580 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 4.3220 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 5.8010 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 6.1970 0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3000 6.7660 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 8.1400 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0850 9.0370 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3920 8.5820 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6590 7.2240 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6240 6.3140 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5100 9.5520 -0.0120 N 0 3 0 0 0 0 0 0 0 0 0 0 6.2780 10.7480 -0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6610 9.1550 -0.0250 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1220 4.1570 0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -2.1630 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1690 -2.7800 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 -2.7640 -0.0330 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9030 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -0.5230 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3350 1.9360 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0570 4.0580 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 8.4960 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8850 10.0980 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6820 6.8760 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 5.2540 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 4.0670 -0.8960 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 20 2 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M CHG 1 21 1 M CHG 1 23 -1 M END