PUBCHEM-ZINC06384781 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 0 0 1 0 0 0 0 0999 V2000 -0.0550 1.4760 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 0.0250 -0.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -0.6140 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 0.0240 -0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -1.9580 -0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 -2.5790 0.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2800 -1.9300 -0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9620 -2.7910 1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 -2.9540 2.4840 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -3.9060 -0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -4.5500 -0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 -5.7660 -1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 -6.3390 -2.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 -5.6950 -1.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6690 -4.4810 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 -3.7940 -0.9940 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.0000 -4.3390 -1.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9990 -2.6830 -0.4960 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9630 1.8630 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 1.8290 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 1.8270 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -4.1030 -0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -6.2690 -1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3720 -7.2890 -2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5290 -6.1420 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 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 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 3 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END