PUBCHEM-ZINC03739513 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 1.8060 2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 1.7720 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8020 1.5370 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1680 1.7420 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8240 2.1820 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 2.4210 2.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7290 2.2140 2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8080 2.8920 3.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9740 2.3890 4.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3020 3.1420 5.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3560 3.0910 6.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3780 3.9550 7.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3600 4.8840 7.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3120 4.9520 6.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2680 4.0820 5.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3740 3.9050 4.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5600 4.4180 4.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5150 3.8990 8.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1700 2.9410 9.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1090 2.3620 9.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7790 1.2670 3.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3160 -0.0670 3.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1340 -1.2060 3.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6710 -2.5400 3.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 2.8400 2.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 1.1370 2.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 1.6260 3.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 1.1940 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7250 1.5580 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8920 2.3410 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1690 2.3970 3.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1520 2.3720 5.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3920 5.5600 8.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5250 5.6780 6.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6840 4.8920 8.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4190 3.5590 7.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8350 1.4160 3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6340 1.2570 2.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2600 -0.2160 3.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4610 -0.0560 5.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1900 -1.0570 3.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9890 -1.2160 2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6150 -2.6890 3.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8160 -2.5290 5.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1690 -4.5260 3.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0400 2.7300 10.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4560 -3.6340 3.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4440 -3.4850 3.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 1.5580 1.2130 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7740 2.1060 10.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 53 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 3 53 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 50 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 51 1 0 0 0 0 49 51 1 0 0 0 0 50 54 1 0 0 0 0 51 52 1 0 0 0 0 M END