PUBCHEM-ZINC05925297 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 51 0 0 1 0 0 0 0 0999 V2000 3.0130 -0.0680 2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 0.3080 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 -0.4550 1.0940 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0500 -1.5260 1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -0.1100 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -0.2260 2.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1960 -0.5130 1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -1.1070 3.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -0.6520 4.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -2.4450 3.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -3.4320 4.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -3.9650 4.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 -5.0770 5.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 -5.6370 5.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 -6.7330 6.1800 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 -8.0210 5.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 -8.3460 4.8300 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -9.0060 6.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 1.1500 2.7210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 1.4080 3.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 2.0830 2.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 1.9000 1.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 3.3840 2.9230 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4170 4.1230 2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 3.4310 4.4260 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4760 2.5030 4.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2810 3.8670 3.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 4.4860 5.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 4.9520 6.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1070 -1.1530 2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0180 0.3490 2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 0.3400 3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 1.3910 1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7390 0.0980 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -0.4040 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -0.6420 -0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 0.9640 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -2.7570 2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -2.9850 5.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 -4.2420 4.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 -4.3460 3.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 -3.1480 4.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 -4.6960 6.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 -5.8820 5.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 -5.9930 4.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8650 -4.8630 5.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7550 -6.5420 7.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 -8.9540 7.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2580 -10.0160 6.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1690 -8.7850 7.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 4.8340 4.7760 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 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 35 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 8 1 0 0 0 0 6 19 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 21 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 25 1 0 0 0 0 23 27 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 M CHG 1 51 -1 M END