PUBCHEM-ZINC04776604 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 0 0 0 0 0 0999 V2000 -0.1400 1.5030 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 0.2000 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -0.5480 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -1.5900 -1.2100 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -2.3900 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4730 -2.2480 -0.7580 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -3.3480 -2.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -4.2510 -2.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7960 -4.7440 -3.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8420 -5.6350 -3.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5640 -6.0350 -2.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2400 -5.5460 -1.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1920 -4.6590 -1.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6850 -6.9890 -2.9520 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.9710 -7.4210 -4.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3210 -7.3430 -1.9750 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7980 2.0390 -0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 2.0410 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -0.3380 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 -1.0070 0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 0.1440 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -1.7040 -1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -3.4130 -2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 -4.4310 -4.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0970 -6.0180 -4.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8060 -5.8600 -0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9370 -4.2800 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END