PUBCHEM-ZINC05426136 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 23 0 0 1 0 0 0 0 0999 V2000 -0.0580 1.5130 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0110 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -0.5180 -1.3420 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3610 -0.2390 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 -0.0450 -1.7760 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 1.2400 -2.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 2.1410 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 1.2380 -3.2850 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3320 2.2810 -3.8080 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5970 3.2730 -3.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 2.1000 -4.9850 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5080 -2.0780 -1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 -2.5000 -1.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 1.9080 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 1.7880 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -0.3890 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 -0.4050 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 -0.8530 -1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 3.1540 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 1.6070 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 0.3850 -3.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 2.2810 -1.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -2.7160 -0.9570 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 14 1 0 0 0 0 1 15 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 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 12 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 8 1 0 0 0 0 6 22 2 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 12 13 2 0 0 0 0 12 23 1 0 0 0 0 M CHG 1 9 1 M CHG 1 11 -1 M CHG 1 23 -1 M END