PUBCHEM-ZINC04762693 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 22 0 0 1 0 0 0 0 0999 V2000 -0.2550 1.4110 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 2.7350 1.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 3.4720 2.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 3.0990 2.7800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 4.5460 3.4560 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 5.4150 4.3190 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5540 4.7580 4.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 6.2930 3.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 7.0630 2.5350 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9410 7.6130 2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 6.3240 5.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 6.1920 5.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 1.1350 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 0.4900 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 1.8770 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 3.3810 1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 1.8670 2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 4.8230 3.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6840 5.6710 3.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4940 6.9820 4.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 2.3270 0.6540 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 1.8790 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 7.0450 6.0460 O 0 5 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 2 21 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 21 22 1 0 0 0 0 M CHG 1 23 -1 M END