PUBCHEM-ZINC05140356 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 0.2270 1.4940 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 0.0080 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -0.2790 0.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 -0.4910 -1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5410 -0.8380 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5640 -0.7430 0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2790 -0.3820 1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 -0.1910 2.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 -0.3690 3.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2530 -0.7260 3.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5620 -0.9110 1.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6210 -1.1810 -1.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6850 -0.7210 -2.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7380 -2.0430 -1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0250 -1.4720 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1570 -2.1820 -0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9710 -3.4790 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6970 -4.0540 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5610 -3.3550 -0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2330 -4.0600 -0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 -3.8030 -1.5920 O 0 5 0 0 0 0 0 0 0 0 0 0 -9.5380 -1.5650 -0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6040 -0.3320 -1.0820 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.7250 -0.4050 -2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 1.6710 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 1.9030 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 2.0540 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -0.5570 -0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -0.3880 1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 0.0900 2.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 -0.2280 4.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0290 -0.8630 3.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5780 -1.1810 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1490 -0.4590 -1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8300 -4.0540 0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5870 -5.0710 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 -1.3760 -2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2970 0.3310 -2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 -0.0990 -2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0170 -4.8860 0.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5290 -2.3220 -0.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 40 2 0 0 0 0 22 23 1 0 0 0 0 22 41 2 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 M CHG 1 21 -1 M CHG 1 23 -1 M END