PUBCHEM-ZINC06520616 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 27 0 0 0 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 0.0250 -0.8650 1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.1140 0.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.1100 -0.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7580 -1.0570 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.3060 -2.3990 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0340 -0.4080 2.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -1.2760 3.5520 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -0.8420 4.8840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -1.7740 5.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -1.3450 7.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -2.2710 8.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -3.6230 7.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -4.0540 6.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -3.1340 5.6360 C 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 0.0220 0.6490 2.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 0.1070 5.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -0.2890 7.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -1.9380 9.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -4.3450 8.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -5.1110 6.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -3.4710 4.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 8 9 2 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 2 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 M CHG 1 6 1 M CHG 1 7 -1 M END