PUBCHEM-ZINC05979232 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 -0.0840 -1.1720 -0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 -1.6800 -1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8520 -0.7780 -1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8500 -0.3730 -2.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -0.2920 0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8930 1.1750 1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 1.4590 2.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0640 2.8850 2.8260 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3440 3.5610 3.0280 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9420 3.3580 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9730 5.0290 3.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8140 6.0660 3.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4060 7.4710 3.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 8.1580 1.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8010 9.4920 1.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6680 10.1680 3.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8990 9.4760 4.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2700 8.1420 4.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1800 5.8600 3.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 5.1080 3.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7870 6.0900 3.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 3.7240 2.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 3.4560 2.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0620 3.0750 4.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3900 2.8890 5.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0750 2.4380 6.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4420 2.1770 6.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1170 2.3740 5.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4430 2.8170 4.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4580 2.1200 5.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -1.9820 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -0.3640 -1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -0.7980 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 -2.0580 -2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 -2.4800 -0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5740 -0.1620 -0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1110 -1.8330 -1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1580 -0.9760 -3.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8510 -0.5040 -3.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 0.6790 -2.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 -0.5370 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3190 -0.9720 1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 1.8060 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 1.4550 0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7810 0.9290 3.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0190 1.1130 3.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2570 7.6730 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 10.0710 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 10.0430 5.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4420 7.6440 5.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6230 6.7270 3.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 3.0890 5.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5420 2.2930 7.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9790 1.8280 7.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9870 2.9780 3.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7920 2.2810 4.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4780 -0.5480 -0.6820 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0900 0.3000 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 57 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 57 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 5 57 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 45 1 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 18 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END