PUBCHEM-ZINC05626487 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 4.1600 -1.5450 -5.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 -2.7760 -4.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4950 -2.8690 -3.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8670 -1.7080 -2.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3610 -0.4550 -3.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.3950 -4.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7500 0.7020 -2.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3000 1.9250 -3.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5670 0.5550 -1.6090 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0150 -0.6360 -1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6890 -1.7420 -1.8680 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4740 2.1840 -2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9420 -0.7240 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1560 -0.9050 1.1630 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8270 -2.2540 1.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9170 -2.7430 2.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5740 -4.1520 3.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2300 -4.1260 3.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1400 -3.6370 2.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4830 -2.2280 2.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7350 0.1700 1.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2060 1.0990 1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9170 0.2190 3.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1580 1.4380 3.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3270 1.4770 5.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2580 0.3110 6.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0190 -0.9000 5.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8420 -0.9520 4.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4400 0.3600 7.5400 N 0 3 0 0 0 0 0 0 0 0 0 0 7.6510 1.4260 8.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3800 -0.6640 8.1960 O 0 5 0 0 0 0 0 0 0 0 0 0 3.4990 -1.4990 -5.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3710 -3.6730 -5.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8710 -3.8320 -3.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1090 0.5550 -4.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6150 -1.5720 -0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5250 0.1940 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7640 -2.9290 0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8750 -2.7620 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9810 -2.0680 3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5110 -4.8260 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3510 -4.5000 3.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9850 -5.1300 4.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2930 -3.4510 4.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0760 -4.3120 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1820 -3.6180 3.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5460 -1.5540 3.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7060 -1.8800 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2130 2.3480 3.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5140 2.4190 5.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9670 -1.8070 6.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6510 -1.8980 3.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 11 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 M CHG 1 29 1 M CHG 1 31 -1 M END