PUBCHEM-ZINC05503394 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 23 0 0 1 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 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 -1.2100 2.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -0.1630 1.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6520 -0.6800 2.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3160 -0.2800 0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4320 -0.9290 0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1770 -1.5390 -0.5740 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -1.2890 -0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -1.7790 -2.1630 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1300 -1.4840 -2.3930 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -2.4780 -2.9460 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 2.1140 -0.3280 3.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -1.7700 2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 -0.3300 2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 0.3080 1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3680 -0.9530 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 2 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 M CHG 1 13 1 M CHG 1 15 -1 M END