PUBCHEM-ZINC05856294 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 46 0 0 1 0 0 0 0 0999 V2000 -1.7540 3.6910 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 2.6690 1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 2.9870 2.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 1.3850 0.9270 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 0.1860 1.7790 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9730 0.3590 2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0670 -0.0890 2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0230 -0.3070 1.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2120 -0.8080 1.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5720 -0.9840 2.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0020 -1.1180 0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8390 -2.1540 0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0720 -3.1960 1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3730 -3.4090 1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6280 -4.4060 2.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5740 -5.1910 3.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2870 -5.0160 2.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0260 -4.0120 1.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2120 -5.7830 3.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1800 -7.0650 2.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9890 -7.5680 1.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9720 -7.7750 3.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8500 -6.2040 4.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5740 -5.8470 5.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1460 -4.7710 5.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8820 -7.0130 6.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -1.0700 0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 -0.8120 -0.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 4.0110 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 3.2780 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 4.5530 0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 1.1670 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 -0.9660 3.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 0.7680 2.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8670 -0.4410 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3990 -2.2770 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1940 -2.7870 1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6350 -4.5610 3.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0120 -3.8720 1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0480 -7.8680 4.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 -8.7770 2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0670 -7.2280 2.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2490 -7.8620 6.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6740 -6.7400 7.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9390 -7.2760 6.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -2.1730 1.6020 O 0 5 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 27 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 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 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 M CHG 1 46 -1 M END