IFLAB-ZINC02458716 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 27 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2190 -0.5500 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4350 0.7210 -0.0170 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 1.9580 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 -2.2790 -0.0240 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.4360 0.5070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -2.9150 0.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -2.7520 -1.6090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 -2.2630 -2.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9670 -2.2130 -1.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9450 -1.7210 -2.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6460 -1.3020 -4.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 -1.3310 -4.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3630 -1.8170 -3.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 -0.8460 -5.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 -0.8700 -6.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 1.9480 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -0.5970 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 3.0240 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -3.3700 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 -2.5540 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9690 -1.6800 -2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 -1.8450 -4.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1210 -0.3790 -6.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8870 -0.0730 -7.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 18 1 0 0 0 0 2 3 2 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 20 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 2 0 0 0 0 16 25 1 0 0 0 0 25 26 1 0 0 0 0 M END