PUBCHEM-ZINC05922908 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 38 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 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -2.0580 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 -2.5760 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 -4.0000 -0.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1310 -4.5880 -0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9990 -6.0420 -0.5970 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 -6.7540 -0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -8.0570 -0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4950 -8.1490 -0.8070 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.0180 -6.9440 -0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4530 -6.6220 -0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3270 -7.5710 -0.8750 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7080 -7.2620 -0.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2540 -9.3940 -0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 -0.1620 1.2730 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.0840 0.5310 1.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -0.5450 2.3320 O 0 5 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -2.3370 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 -2.4940 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -2.2960 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 -2.1400 -1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7180 -4.3500 0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6330 -4.1930 -1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 -6.3510 -0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4730 -8.8850 -0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7790 -5.5950 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2820 -8.0350 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4910 -9.7930 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1770 -9.1950 -1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6560 -10.1200 -1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 18 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 12 1 M CHG 1 18 1 M CHG 1 20 -1 M END