PUBCHEM-ZINC06691950 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3290 0.0090 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 -1.2700 -0.7620 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 -0.0840 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6710 -0.7960 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6490 -2.1790 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 -2.8570 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -2.1560 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9210 -2.9360 0.0350 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.9840 -2.3420 0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9040 -4.1540 0.0290 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2200 -0.6850 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 0.0320 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 -0.6260 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 -1.8420 -0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8690 0.1300 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1740 -0.4160 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0110 0.6470 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2450 1.7590 -0.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5860 2.6680 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 1.4410 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5170 0.5990 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2660 1.6840 0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2520 1.7100 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8820 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8560 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 0.9960 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6160 -0.2720 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 -3.9370 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -2.6870 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -1.6550 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 1.0020 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4450 -1.4620 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9560 -0.3980 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6700 2.4330 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1980 1.4010 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1740 1.4430 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6460 2.4750 -1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 34 1 0 0 0 0 23 24 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 M CHG 1 9 1 M CHG 1 11 -1 M END