IBS-ZINC06669516 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 26 0 0 1 0 0 0 0 0999 V2000 0.0920 1.5110 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -0.0070 0.0510 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8900 -0.3720 -0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -0.4220 1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -1.0370 2.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -0.6280 -0.0920 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 -0.7090 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -0.3110 -2.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 -0.3360 -3.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4720 -0.7930 -3.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0360 -1.2040 -2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2530 -1.1540 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 -1.5550 0.0630 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.5810 -0.7120 0.6390 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6860 -2.7190 0.4380 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.3040 -1.5850 -2.5350 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5300 -1.4190 -3.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4100 -0.9340 -4.5440 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 1.9750 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 1.8890 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 1.8640 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -1.0430 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 0.0360 -2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 -0.0260 -4.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 -0.1090 1.6970 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 18 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M CHG 1 25 -1 M END