PUBCHEM-ZINC06072013 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 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 0.0220 -0.6940 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.0620 1.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7260 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.9420 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0630 -1.2050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.5570 -2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.7150 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.1140 -2.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.8120 2.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -3.0910 2.8480 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8860 -3.6770 2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -3.8740 4.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7170 -4.2450 4.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9940 -5.3290 4.6460 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.2710 -6.4120 4.7580 N 0 5 0 0 0 0 0 0 0 0 0 0 -2.0600 -1.8540 3.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1690 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -3.7550 2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -2.2260 3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 -4.7750 4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 -3.2530 4.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 -1.2800 3.7080 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 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 11 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 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 16 17 2 0 0 0 0 18 27 1 0 0 0 0 M CHG 1 16 1 M CHG 1 17 -1 M END