PUBCHEM-ZINC06522002 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 32 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6980 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0850 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.7880 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -2.0960 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6920 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -0.0110 -2.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -0.5920 -3.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 0.1950 -4.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -0.3970 -5.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 -1.7780 -5.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -2.5780 -4.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -1.9900 -3.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.8160 -2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -4.0130 -2.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -2.3940 -7.3000 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4290 -1.6880 -8.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -3.6070 -7.4100 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0600 -2.8120 2.4950 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0600 -2.1920 3.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -4.0290 2.5080 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1560 2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -3.8680 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 1.2710 -4.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 0.2220 -6.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -3.6530 -4.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M CHG 1 20 1 M CHG 1 22 -1 M END