PUBCHEM-ZINC05599695 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 58 0 0 1 0 0 0 0 0999 V2000 -2.0620 0.8170 0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 0.8870 0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 2.9990 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 3.5890 2.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 2.9750 3.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 3.4810 4.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 2.8950 5.9240 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9030 1.8070 5.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 3.2330 7.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 2.6380 8.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 2.7810 9.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1000 3.4680 9.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6890 3.5480 10.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 2.9490 12.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8690 2.2670 11.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 2.1730 10.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 1.5300 10.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 0.7100 11.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 3.5050 6.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 2.6390 5.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 3.3280 6.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 2.8520 8.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 5.1220 7.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 -0.2590 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 1.0410 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7750 1.1900 1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 1.0960 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 -0.1890 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 1.3370 0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 3.2630 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 3.3430 1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 4.6710 2.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 3.4030 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 4.5750 4.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7060 3.1980 4.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8990 4.3210 7.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 2.8280 7.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6150 3.9520 8.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6300 4.0780 11.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5380 3.0130 13.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 1.8230 12.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 0.1840 11.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 1.3190 12.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 -0.0450 11.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 1.6700 6.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 2.4870 4.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5120 2.6670 6.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 4.1900 5.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5420 2.5590 8.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 1.9930 8.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 3.3060 9.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 5.8680 7.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2010 4.8820 7.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 5.4870 8.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 1.4870 1.2110 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4810 1.3230 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 3.8750 7.6680 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3570 4.1310 7.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 55 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 55 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 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 7 19 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 42 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 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 21 57 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 22 57 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 23 57 1 0 0 0 0 55 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 55 1 M CHG 1 57 1 M END