IFLAB-ZINC01917472 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 0 0 0 0 0999 V2000 -0.0280 0.6460 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -0.6850 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -0.9640 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 -0.0180 -0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 1.2750 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 1.6530 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3450 2.3070 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0460 3.4940 -0.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 1.7470 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7540 2.4780 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9180 3.7740 -0.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2740 4.0660 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8450 5.3570 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2350 5.5070 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0460 4.3770 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5180 3.0810 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1210 2.9540 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1630 1.5230 0.0470 S 0 0 0 0 0 0 0 0 0 0 0 0 11.8450 4.5740 0.0700 S 0 0 0 0 0 0 0 0 0 0 0 0 12.3030 3.3930 -0.6580 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0440 5.8380 -0.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2370 4.5970 1.6100 N 0 5 0 0 0 0 0 0 0 0 0 0 12.0190 3.6890 1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 0.8980 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -1.4870 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 -1.9890 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 2.6980 -0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6700 0.7350 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1980 6.2280 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6730 6.5010 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1640 2.2100 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 M CHG 1 22 -1 M END