PUBCHEM-ZINC05157292 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 0.1890 1.8970 -0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 0.6300 -0.0900 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2910 0.6270 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 0.6780 0.2500 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1270 0.7180 1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 -0.0190 -0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 -1.2320 -0.9010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -0.0660 -1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 -1.5150 -1.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1160 -1.6210 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4570 -2.0430 -2.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 -3.0210 -2.7630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 2.2030 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 2.7270 0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 0.5090 -1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -0.0140 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 0.6050 -0.9440 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.5690 -1.4950 -2.3740 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3640 -2.3960 -0.9210 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3310 -3.0060 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -1.8800 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -2.9860 -1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 17 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 11 12 2 0 0 0 0 11 18 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 M CHG 1 17 -1 M CHG 1 18 -1 M CHG 1 19 1 M END