PUBCHEM-ZINC05424291 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0040 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 -2.8180 -1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -4.0850 -1.5480 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -4.0870 -1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 -2.8090 -0.8200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 -2.3660 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 -2.2280 1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1170 -1.7960 1.8350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -5.2920 -0.6630 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6940 -6.4000 -0.8840 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2510 -5.1740 -0.1600 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 -2.5050 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -3.0990 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 -1.4030 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 -1.4950 1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -3.1920 1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0970 -1.6870 2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M END