PUBCHEM-ZINC04004968 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 1.9080 1.1280 -0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -0.0360 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 -0.5250 1.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -1.1300 2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -1.5630 3.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -1.2630 1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -1.6030 3.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 -2.6750 3.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 -2.8440 4.4270 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0600 -1.8970 4.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6710 -3.9200 4.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8940 -3.4380 3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9460 -2.7340 4.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8790 -2.5110 3.1250 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7500 -2.0160 3.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4660 -3.0600 1.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2160 -3.6380 2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5600 -4.2660 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1810 -4.3070 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4350 -3.7320 -0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0990 -3.0910 0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 -3.2730 5.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 -4.5140 5.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -0.0410 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 0.4370 1.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 0.5050 0.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -1.1220 -1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 0.8100 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 1.5760 -1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 1.9180 0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -0.8850 3.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -2.1030 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2660 -4.8010 3.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9970 -4.2700 5.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1060 -2.3800 5.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5810 -4.7140 1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6750 -4.7950 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9060 -3.7790 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0730 -2.6380 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 -1.5080 -1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 -1.9770 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -0.7410 -2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -2.3030 6.1400 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 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 13 35 1 0 0 0 0 14 15 1 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 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 M CHG 1 43 -1 M END