PUBCHEM-ZINC03767769 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 -1.7150 -0.7150 2.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -0.7530 1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -0.2910 1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 0.2430 2.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 -0.5010 2.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 -2.0100 2.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 0.0430 3.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 0.7380 5.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4670 1.0980 5.7500 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6040 0.6200 5.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1870 -0.0300 3.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1700 -0.5790 3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5220 -0.4850 3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9090 0.1490 4.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9600 0.7170 5.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4460 1.8750 6.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 1.7900 2.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 2.3000 2.9820 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5830 -0.3110 -0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 0.3890 -1.0550 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.1290 -1.3550 0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -0.2460 3.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6550 -0.1530 3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 -1.7330 3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 -2.3690 2.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 -2.4230 3.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -2.4500 2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 1.0200 5.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8770 -1.0610 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2720 -0.9080 2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9640 0.2150 4.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2690 1.2230 6.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 1.2730 7.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0310 2.7850 6.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 2.1390 7.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9870 -0.6900 0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 -1.5520 -0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4990 -2.3170 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 2.3710 1.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -1.0840 -0.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 17 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 16 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 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 32 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 39 2 0 0 0 0 19 20 1 0 0 0 0 19 40 2 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 M CHG 1 18 -1 M CHG 1 20 -1 M END