PUBCHEM-ZINC04789472 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7020 -0.4890 1.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0360 -0.6930 0.7000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5640 0.2550 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 -1.7060 1.4620 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0990 -1.3280 2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 -1.8940 0.6670 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7730 -2.6790 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 -2.2820 -0.7810 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4730 -3.2880 -0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9610 -1.3740 -1.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -1.3100 -0.6960 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3540 -2.3220 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -0.4750 -1.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2000 -2.2660 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9340 -2.6370 -2.9640 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1800 -1.9200 -3.7940 N 0 3 0 0 0 0 0 0 0 0 0 0 5.4250 -1.2020 -4.6230 N 0 5 0 0 0 0 0 0 0 0 0 0 4.9190 -0.6720 0.6850 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 -2.9480 1.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 -0.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6330 -1.2670 -1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8980 -2.9790 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7560 -0.7120 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6580 -3.6370 2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -0.1690 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -1.6280 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -0.2000 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 13 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 17 18 2 0 0 0 0 18 19 2 0 0 0 0 20 28 1 0 0 0 0 21 29 1 0 0 0 0 22 30 1 0 0 0 0 22 31 1 0 0 0 0 22 32 1 0 0 0 0 M CHG 1 18 1 M CHG 1 19 -1 M END