IBS-ZINC04811671 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 -0.5160 0.0170 0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -0.0780 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 0.5320 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 1.1480 1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 1.2150 2.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -0.8300 -1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -0.1730 -2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 1.2920 -2.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 1.9600 -3.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 3.3420 -3.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 4.0170 -2.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 3.3660 -1.5870 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 2.0510 -1.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -2.2880 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -2.9240 -2.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 1.0650 1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 -0.4640 0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -0.4820 1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 0.5500 -0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -0.7380 -3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 1.4080 -4.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 3.8890 -4.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 5.0970 -2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 1.5540 -0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2620 1.6610 1.5880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -2.9150 -0.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -3.8730 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 2.0600 2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 13 24 1 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 M END