PUBCHEM-ZINC05050290 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 0 0 0 0 0 0999 V2000 0.1780 1.4140 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -0.0080 -0.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -0.5900 1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -2.1070 1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 -2.7310 2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -4.1830 2.1630 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 -4.9710 3.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 -4.3700 4.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -5.1470 5.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1300 -6.5410 5.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -7.1410 3.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 -6.3580 3.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -6.9920 1.9480 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3510 -7.9980 2.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 -6.5090 0.8300 O 0 5 0 0 0 0 0 0 0 0 0 0 3.8050 -7.3770 6.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7330 -8.5890 5.9580 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5020 -6.7970 7.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 1.6820 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 1.7790 -0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 1.8640 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 -0.3630 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -0.1810 1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -2.3340 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -2.5160 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 -2.5040 2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -2.3220 3.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -4.5950 1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 -3.2940 4.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 -4.6810 5.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 -8.2170 3.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5600 -5.8300 7.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9470 -7.3460 7.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 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 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 16 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END