IFLAB-ZINC04275717 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -1.8460 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -2.5740 -0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 -2.4240 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0760 -1.6330 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1780 -2.3680 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7880 -4.0790 0.0260 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1110 -3.7740 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 -4.7540 -0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4810 -6.0560 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -6.3690 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -7.1220 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 -8.4810 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 -9.0930 -1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9750 -10.3400 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 -10.9760 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9450 -10.3640 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -9.1190 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0810 -0.5530 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1810 -1.9690 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 -4.5030 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -7.0070 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -7.0240 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 -8.5960 -2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2200 -10.8180 -2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7250 -11.9500 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -10.8600 2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 -8.6430 2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 28 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 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 M END