IFLAB-ZINC04271741 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 39 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3820 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 1.2180 -0.6610 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 0.0150 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 1.3340 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 2.0590 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 2.0580 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2050 2.3580 -1.7310 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7310 3.1920 -1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5200 3.6360 -2.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3990 3.5840 -3.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4420 4.1610 -4.4620 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2920 4.6180 -3.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7300 4.2970 -2.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0800 4.4750 -0.9710 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3100 4.0430 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1640 3.4230 -0.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5090 5.2870 -3.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3250 4.9590 -4.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5240 5.6200 -4.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9120 6.6090 -4.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1000 6.9380 -2.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8980 6.2830 -2.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0860 7.2550 -4.1820 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 1.9230 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -0.5640 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -1.7410 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 3.1380 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5870 3.0110 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4430 1.4500 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5800 3.1400 -4.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6260 4.2040 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0230 4.1880 -5.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1590 5.3650 -5.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4040 7.7090 -2.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2620 6.5420 -1.9130 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 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 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 17 2 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 M END