IBS-ZINC00500011 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 36 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3840 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 1.1960 -0.6890 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0130 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 1.4180 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7740 1.8610 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5530 0.7060 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -0.3940 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0130 -1.3170 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9600 0.8480 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6860 -0.1320 -0.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4810 2.0940 -0.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6660 3.1800 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3690 3.0670 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9340 2.2750 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4210 2.3450 -1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5910 3.5760 -2.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0390 3.6290 -3.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 2.4360 -4.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1060 1.2420 -3.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6830 1.2300 -2.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -1.7690 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1070 4.1660 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1900 3.2010 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4100 1.4340 0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3780 4.4860 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1820 4.5770 -3.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6500 2.4400 -5.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3070 0.3090 -3.8900 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 20 21 2 0 0 0 0 20 32 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 M END