PUBCHEM-ZINC05899921 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 58 0 0 1 0 0 0 0 0999 V2000 1.6870 0.8700 3.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 0.3430 2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 -0.9090 2.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -1.4630 0.8190 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0410 -0.6570 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 -2.6350 0.2300 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5260 -2.9790 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4330 -2.2900 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6300 -1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 -1.2880 -1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0830 -1.5980 -0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8010 -2.2490 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 -2.5930 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -3.7370 1.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -2.1680 -0.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6630 -2.1350 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -0.9960 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 0.3690 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6700 1.4530 -0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 -3.5220 0.1570 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9190 -3.4900 -0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 -4.7050 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -4.8800 -1.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 -5.9500 -2.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -6.8650 -1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -6.7120 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 -5.6410 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 -3.6820 1.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7330 1.1370 3.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 1.7660 4.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 0.1220 4.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 0.1330 2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 1.1270 1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7960 -0.6370 1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -1.6850 2.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 -1.3790 -2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2670 -0.7800 -2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1070 -1.3320 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6070 -2.4870 1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2930 -3.0890 1.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 -4.4580 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0160 -1.1860 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -0.9610 1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 0.6500 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 0.3280 -1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3990 1.2370 -1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2060 1.5380 0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 2.4220 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -4.1890 -2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -6.0760 -3.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -7.7030 -1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -7.4320 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -5.5500 1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8680 -4.4730 1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -2.0370 1.1290 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0170 -2.9930 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 -1.5880 1.9300 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 32 1 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 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 55 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 15 55 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 28 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 M CHG 1 55 1 M END