PUBCHEM-ZINC02047581 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 32 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3810 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 2.0460 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 1.2910 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 -0.1050 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1160 -0.6980 0.0040 N 0 3 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 -3.5340 -0.9260 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 -2.2940 0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8020 -2.8890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8980 -2.6660 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5520 -3.8870 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9440 -3.9210 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6780 -2.7280 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0410 -1.5240 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6400 -1.4700 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7570 -0.4520 0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6500 -5.2200 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0280 -5.2560 0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6140 1.8990 0.0300 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9080 1.9380 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 3.1250 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -0.5230 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9860 -4.8060 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7570 -2.7620 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6160 -0.6090 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5350 -4.4290 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4910 -6.1090 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 -1.6670 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9700 -6.3320 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 -6.3070 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 29 2 0 0 0 0 18 26 1 0 0 0 0 18 27 1 0 0 0 0 29 30 1 0 0 0 0 M CHG 1 5 1 M CHG 1 19 -1 M END