IFLAB-ZINC01247611 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 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 1.2030 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.0350 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4330 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0950 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 -0.6800 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 -1.8920 -0.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 0.0960 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1630 -0.8790 -0.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0710 -1.5780 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4720 -0.1290 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7640 0.5900 -1.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2720 -0.3230 0.8970 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8880 -1.1470 1.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5860 -1.4220 3.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0630 -2.2870 3.9720 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7560 -2.5600 5.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2080 -3.4670 6.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8080 -3.8440 7.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9910 -4.6950 7.9090 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2010 -5.0970 8.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8220 -4.9010 7.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8980 -4.1420 6.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8410 -4.1540 5.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 -4.9110 5.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6430 -5.6580 6.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6840 -5.6620 7.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -1.7770 1.5250 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -1.7610 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 1.9930 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.1750 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0230 0.7270 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0390 0.7190 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1340 0.1190 0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7320 -2.1190 5.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7840 -3.5190 7.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9000 -3.5730 4.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 -4.9220 4.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 -6.2460 6.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6120 -6.2460 8.3620 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 34 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 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 29 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 26 27 2 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 M END