PUBCHEM-ZINC05967121 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.3900 1.3720 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -0.0570 -0.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -0.8750 1.1450 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8420 -1.0430 1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -2.1850 0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -2.2560 -0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 -0.8060 -1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -0.3990 -2.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 -0.2910 2.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 0.2080 1.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2330 0.7000 2.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8600 0.6860 4.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 0.2090 4.4200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7890 -0.2820 3.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 0.2000 5.8680 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1760 0.2980 5.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -1.1010 6.5330 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8880 -1.0670 6.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -1.0360 8.0540 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3900 -1.1280 8.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 0.2640 8.6850 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0760 0.2390 8.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 1.4650 7.8740 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3850 1.5670 7.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 1.3500 6.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 2.7480 8.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3570 3.7030 7.7360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 0.3760 10.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 1.3120 10.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 -2.1810 8.6580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 -2.8680 7.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -2.1680 6.0510 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5310 1.8890 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 1.7420 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 1.5730 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7180 -2.1720 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -3.0520 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 -2.7820 -1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -2.7220 -0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 0.2130 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2050 1.0870 2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 1.0530 4.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -0.6820 3.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 2.6830 9.7810 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 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 42 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 25 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 32 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 30 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 28 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 28 29 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 13 1 M CHG 1 32 -1 M CHG 1 44 -1 M END