PUBCHEM-ZINC05944693 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 38 0 0 1 0 0 0 0 0999 V2000 0.0530 1.3840 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -0.0100 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -0.7080 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 0.0170 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 1.4220 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 2.1150 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 3.5960 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 4.0810 0.6720 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 4.3620 -0.0940 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 5.8370 -0.0140 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3760 6.2110 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 6.3430 1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 5.6530 2.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1790 4.7280 1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5150 6.4300 -0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3570 5.5530 -1.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -2.1910 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -2.7050 -0.6850 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 -2.9270 0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -4.4020 -0.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5300 -4.8000 0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 -4.9080 -1.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 -4.1920 -2.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2710 -3.2680 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -4.9600 0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4960 -4.0610 1.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 1.8940 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -0.5460 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4460 -0.4780 -0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4140 1.9430 0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0950 3.9860 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 7.4160 1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 6.1670 1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1880 -2.5290 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 -5.9750 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -4.7580 -1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 7.6830 -0.8590 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7230 -6.2120 0.8150 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 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 31 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 15 16 2 0 0 0 0 15 37 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 34 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 25 26 2 0 0 0 0 25 38 1 0 0 0 0 M CHG 1 37 -1 M CHG 1 38 -1 M END