PUBCHEM-ZINC06138674 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -1.9980 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -2.6880 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 -2.0960 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -4.1950 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 -4.7250 0.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5230 -4.3020 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 -6.2270 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1900 -6.8290 1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1720 -8.2070 1.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9310 -8.9830 0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 -8.3810 -0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7310 -7.0030 -0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6580 -4.3390 -1.2290 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0010 -4.2300 -1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6550 -4.4520 -0.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6190 -3.8760 -2.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0670 -3.7790 -2.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5860 -3.3680 -3.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 -2.4720 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0410 -4.5460 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 -4.5560 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3780 -6.2230 2.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3450 -8.6780 2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9160 -10.0600 0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5200 -8.9880 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5610 -6.5330 -1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1370 -4.1620 -2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4900 -4.7460 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3630 -3.0310 -1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1630 -2.4010 -4.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2900 -4.1160 -4.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6730 -3.2950 -3.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 16 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 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 M END