PUBCHEM-ZINC06487353 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 1 0 0 0 0 0999 V2000 -0.4630 1.4410 -0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -0.0530 -0.0880 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3410 -0.3780 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -0.4600 1.1800 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0040 -0.3010 2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -2.0010 0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 -2.4160 1.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 0.1250 1.2810 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 1.3500 1.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 2.1850 2.3050 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 3.3940 2.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9880 3.9400 2.5450 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7710 3.1940 1.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5360 3.6320 0.7930 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9070 2.4810 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 1.3430 0.5800 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 1.7220 1.8040 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2040 1.3430 2.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -0.7000 -0.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -1.6500 0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 2.0120 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1160 1.6460 -1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 1.8110 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 -0.5190 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 3.9390 3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5450 2.5400 -0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -2.6310 0.7680 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 19 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 M CHG 1 27 -1 M END