PUBCHEM-ZINC05412532 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 0 0 0 0 0 0999 V2000 -0.4870 1.4090 -0.1890 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 0.5300 -0.3590 1.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -1.6410 1.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -0.9830 -1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 -2.3350 -0.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 -3.2150 -1.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -2.7980 -3.1340 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1130 -1.5340 -3.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.5850 -2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -3.7700 -4.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -3.8510 -4.6390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 -4.7760 -5.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4890 -4.7810 -6.0480 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.9260 -3.9430 -6.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2590 -3.9130 -7.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1500 -4.7900 -6.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6420 -5.6620 -5.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2930 -5.6270 -5.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5850 -4.7940 -7.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0350 -3.9810 -7.9400 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.4120 -3.9850 -8.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5250 -5.7470 -6.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 2.0230 -0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 1.4130 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 1.8120 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 -1.8160 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -2.6830 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -4.2600 -1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -1.2380 -4.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 0.4490 -2.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -3.4520 -5.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -4.7480 -3.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 -4.4790 -6.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7650 -5.7760 -5.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 -3.2700 -7.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6100 -3.2240 -8.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2940 -6.3540 -5.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8910 -6.2980 -4.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6530 -3.3430 -8.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9300 -5.2730 -5.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3410 -6.0080 -7.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9840 -6.6510 -6.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 5 1 0 0 0 0 3 4 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 M CHG 1 8 1 M CHG 1 14 1 M END