PUBCHEM-ZINC04533539 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3420 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -0.3820 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 -1.2920 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 0.7470 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 1.7750 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 -0.9190 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 -1.1210 -1.4240 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8880 -0.1510 -1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 -1.9350 -1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 -3.1220 -1.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1360 -1.3430 -1.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3690 -2.1340 -1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5330 -1.2420 -0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3520 -0.0660 -0.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 1.9650 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 0.7930 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 -1.8820 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -0.4730 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1660 -0.3930 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5300 -2.5760 -2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2830 -2.9250 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -2.7320 -1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7720 -1.7530 -0.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 -1.8300 -2.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 -1.9190 -3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4870 -1.1420 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 17 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 13 22 1 0 0 0 0 14 15 2 0 0 0 0 14 24 1 0 0 0 0 23 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 M END