PUBCHEM-ZINC06761400 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 40 0 0 1 0 0 0 0 0999 V2000 0.1380 1.8950 -1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 0.4370 -2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 0.0420 -2.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 -0.4070 -1.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -1.8680 -1.2770 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1120 -2.1080 -2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -2.5080 -0.7520 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5960 -2.3540 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 -1.9480 -1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 -2.5580 -0.8090 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1350 -2.2700 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3340 -2.1780 -1.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0330 -3.2100 -1.8130 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9270 -4.0080 -0.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -3.9240 -0.9830 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 -4.2350 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 -2.4760 -0.5510 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0030 -3.5620 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 -1.9530 -1.0170 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5260 -0.9170 -0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 -2.7930 -0.3680 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4840 -3.8250 -0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9110 -2.2250 -0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8330 -2.9890 0.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7250 -2.6680 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 -2.8560 1.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1870 -3.1670 1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -1.9880 -2.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -1.2490 -2.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -2.2480 0.8670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -2.5400 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 2.0600 -1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 2.2420 -1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 2.4660 -2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -0.0220 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8230 -0.8570 -1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7500 -2.1980 -2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8230 -4.2500 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1860 -2.2970 -1.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 -1.1840 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5330 -0.9580 -1.7830 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 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 10 12 1 0 0 0 0 10 14 1 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 30 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 28 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 41 -1 M END