PUBCHEM-ZINC03111950 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6990 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0780 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7730 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0650 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.0800 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1410 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -4.7850 0.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 -6.2600 0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -7.1100 1.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -8.3530 1.3030 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4800 -8.3780 0.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -7.0350 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -9.4840 1.8880 O 0 5 0 0 0 0 0 0 0 0 0 0 2.7650 -6.6260 2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1600 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6190 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.5960 -2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 0.2780 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -0.5090 -3.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.0240 -2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -4.2390 1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -6.5230 3.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5810 -7.3450 2.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 -5.6600 2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 M CHG 1 13 1 M CHG 1 16 -1 M END