PUBCHEM-ZINC03869360 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 21 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 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 -2.0110 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 -2.2520 0.0190 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.0950 -2.4270 0.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 0.2460 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 2.0550 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9700 1.6240 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 3.5560 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 4.2510 -0.8480 O 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 0.5120 -0.3560 -0.8950 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 -1.2310 -2.4510 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 -2.4610 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 0.6800 -1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 4.1220 1.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 1.6820 -1.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 2.0710 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 5.0890 1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 14 1 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 7 2 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 4 17 1 0 0 0 0 5 6 3 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 18 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 M CHG 1 5 1 M END