PUBCHEM-ZINC06909955 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.0380 1.7380 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 0.2880 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 0.2640 1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -0.5400 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -2.0550 0.2960 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0040 -2.2860 1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 -2.6790 0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 -3.0420 -0.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4390 -2.7500 1.9570 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 -2.2770 3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 -2.0670 4.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7410 -3.2000 3.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7110 -3.3700 2.3730 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5220 -2.8100 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8610 -4.8870 2.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8010 -5.5760 2.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -2.7010 -0.9390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 -2.9530 -1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 -2.6270 -0.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -3.6150 -2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -4.2470 -3.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -4.7550 -4.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -5.4690 -5.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -5.8300 -6.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9180 -5.5060 -6.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3510 -4.8020 -5.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 -4.4310 -4.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -3.7410 -3.1510 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 -3.2140 -2.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -6.5050 -7.6810 F 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 2.3380 -0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 1.7850 -1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 2.2030 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -0.1080 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 0.6240 2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -0.7440 1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0990 0.9030 1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 -0.1350 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -0.3810 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 -3.0670 3.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -1.3640 2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -2.0850 5.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2570 -1.1020 4.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4080 -4.1050 4.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7460 -2.9630 4.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 -2.9770 -1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -4.3570 -3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 -5.7370 -5.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 -5.8060 -7.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4010 -4.5560 -5.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0020 -3.7700 -1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 -3.3280 -3.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -2.1500 -2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0490 -5.2650 1.8640 O 0 5 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 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 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 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 54 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 28 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 30 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 M CHG 1 54 -1 M END