PUBCHEM-ZINC02972480 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 1.4840 -1.2070 1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -1.1790 1.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 0.2250 2.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -1.6490 0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -1.8080 -0.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 -1.9230 1.4830 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3950 -2.3040 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2850 -3.5920 -0.1090 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6610 -4.2890 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6210 -4.2590 -0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7920 -3.5500 -0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9820 -4.2350 -0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9690 -5.6160 -0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8670 -6.3390 -0.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7280 -5.6490 -0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -4.5310 -1.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -4.1290 -3.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -3.2940 -4.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 -2.1320 -3.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1990 -2.5500 -2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -3.5540 -5.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3570 -3.3150 -6.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -3.5790 -7.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -4.0890 -8.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -4.3360 -7.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 -4.0730 -5.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -4.3000 -9.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -4.8210 -10.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -0.9200 1.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7070 -2.2110 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -0.5200 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -1.8720 2.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 0.9380 1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 0.2460 2.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 0.5780 2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 -1.8330 2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1480 -2.4540 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 -1.4380 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8010 -2.4640 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8980 -3.7020 -1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8710 -6.1950 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8730 -6.2800 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 -5.1980 -2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 -5.0220 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -3.5710 -2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 -5.0550 -3.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 -1.4140 -3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 -1.5950 -4.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6660 -1.6670 -2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9650 -3.2150 -2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 -2.9450 -5.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 -3.3860 -8.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -4.7250 -7.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -4.2540 -5.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -4.9310 -11.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 -4.1310 -9.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -5.8120 -9.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -3.3070 -1.3870 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7020 -2.6670 -1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 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 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 58 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 58 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 20 58 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END