PUBCHEM-ZINC05797696 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 0.5070 1.5780 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 0.1600 0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 -0.3970 1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -0.6390 -1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -0.1310 -2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 -0.9320 -3.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -2.2850 -3.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -2.8170 -2.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -2.0070 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -3.0890 -4.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -4.1280 -5.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -4.8610 -6.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 -4.5140 -7.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -5.9320 -6.5070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -6.8860 -7.6200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2530 -6.3630 -8.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -8.1200 -7.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 -7.8070 -6.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 -7.6160 -7.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2630 -7.3150 -7.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1640 -7.1070 -7.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9980 -7.3330 -5.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 -7.6400 -5.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -7.7110 -4.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9410 -7.4730 -3.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 -7.1670 -3.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8430 -7.0900 -4.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 -7.5110 -7.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -7.4490 -7.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 1.7240 -0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 2.1080 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 2.0630 0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -0.7950 1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -1.1920 1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 0.3570 2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 0.9130 -2.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -0.4740 -4.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -3.8710 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -2.4900 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 -2.7800 -5.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 -4.4580 -4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 -6.1330 -5.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -8.6500 -6.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -8.8370 -8.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1510 -7.6450 -8.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 -7.9380 -4.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5280 -7.5240 -2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 -6.9770 -2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8890 -6.8460 -4.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6480 -7.9990 -9.1280 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 28 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 M CHG 1 50 -1 M END