IFLAB-ZINC04304081 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 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 1.1860 -0.6850 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 0.0190 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 1.4240 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 2.0980 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 1.8220 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0220 2.7360 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 0.6950 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -0.3600 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9660 0.6730 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4910 0.7830 1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0220 0.7250 1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5260 1.7630 0.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0170 1.8040 -0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4860 1.8500 -0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6450 2.8680 0.9780 S 0 0 0 0 0 0 0 0 0 0 0 0 9.5130 4.0010 0.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5180 2.9350 2.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2380 2.1870 0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8700 2.4260 -0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1230 1.8710 -0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6950 1.1020 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0640 0.8960 1.3680 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8750 1.4140 1.6050 C 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 -0.5510 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 -1.7650 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 3.1780 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3110 -0.2620 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1670 1.7290 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1010 -0.0430 1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4040 0.9020 2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3470 -0.2550 1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3960 2.6930 -1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3410 0.9120 -1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0930 1.7830 -1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1620 2.7860 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3980 3.0310 -1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6440 2.0360 -1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6710 0.6660 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3910 1.2270 2.5520 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 25 42 1 0 0 0 0 M END