PUBCHEM-ZINC06631905 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.7650 0.6890 2.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -0.4420 2.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 0.0750 0.7530 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6170 0.7190 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 -1.1540 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -1.4190 -1.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 0.7830 -0.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 2.2130 -0.8690 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 2.5990 -1.7520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6830 3.1430 0.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 1.6910 -1.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2370 0.9910 -3.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2820 0.5280 -3.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5850 0.7860 -3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 1.5100 -2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8250 1.9820 -1.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2760 1.6330 -2.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8600 2.2100 -1.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8960 0.9460 -3.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8570 0.4370 -4.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 -0.2590 -5.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5170 -0.4170 -5.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5300 0.1270 -4.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2310 0.8040 -3.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2230 -0.0410 -5.2950 S 0 0 0 0 0 0 0 0 0 0 0 0 11.0770 0.2750 -4.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3360 -1.3090 -5.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3270 1.1930 -6.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5430 2.6040 -5.9600 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3220 2.7080 -4.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7140 3.5760 -6.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2190 3.4440 -6.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0420 2.9030 -6.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5710 2.0600 -7.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 1.2830 3.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 1.3570 2.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 0.2820 3.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 -1.1170 2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -1.0280 1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 0.0530 -0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.7720 -3.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0570 -0.0330 -4.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0600 2.5240 -0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3920 -0.6660 -5.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7810 -0.9440 -6.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9960 1.2250 -2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1250 1.0060 -7.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0110 4.6080 -6.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9060 3.4260 -7.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6720 4.2050 -7.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8470 2.4650 -6.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9870 3.5800 -5.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2820 -1.6800 0.1560 O 0 5 0 0 0 0 0 0 0 0 0 0 12.5280 3.9180 -5.6880 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 2 0 0 0 0 5 53 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 43 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 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 33 1 0 0 0 0 31 32 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 33 34 2 0 0 0 0 33 54 1 0 0 0 0 M CHG 1 53 -1 M CHG 1 54 -1 M END