PUBCHEM-ZINC06189931 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 0 0 0 0 0 0999 V2000 -0.0040 1.6790 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 0.1730 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -0.4660 0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -1.8460 0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -2.5910 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 -1.9460 -1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -0.5660 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -2.7370 -2.1570 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7840 -2.1760 -3.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -3.9490 -2.0590 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0740 -3.9890 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -4.6130 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -3.9680 2.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 -6.1120 1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -6.5620 2.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 -8.0610 2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -8.7060 1.6900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -8.6850 3.9010 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -10.0780 3.9460 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 -10.6790 5.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -12.1460 5.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -12.9150 6.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 -14.2000 5.8670 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -14.2420 4.4730 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 -13.0250 4.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -12.6280 2.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 -15.3570 6.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 2.0310 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 2.0100 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 2.0840 0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 0.1140 1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -2.3440 1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1430 -0.0640 -1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -4.5090 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -6.5780 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -6.4100 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 -6.0960 3.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -6.2640 3.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -8.1690 4.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -10.1040 5.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -12.5540 7.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -12.4350 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -13.4340 2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -11.7260 2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -15.7410 7.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 -16.1350 6.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 -15.0560 7.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M END