IFLAB-ZINC04139954 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 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 0.5500 -1.9430 1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -2.3970 2.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8210 -0.5790 2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.1250 1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3690 -2.5180 3.7760 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9260 -2.0780 4.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 -2.1250 3.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3710 -1.7960 2.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6790 -1.4360 2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4900 -1.3950 3.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8470 -1.0280 3.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5750 -1.0100 4.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9700 -1.3490 5.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7060 -1.6900 5.8420 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9390 -1.7280 4.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5780 -2.0910 4.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0230 -2.4090 6.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 -4.0190 3.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0650 -4.7230 4.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 -6.0940 4.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 -6.5030 3.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 -5.1100 2.4730 S 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 -1.0200 -0.3810 0.0100 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 1.0040 -2.4510 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 -2.1880 1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -1.9100 3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -3.4790 2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8820 -0.3340 2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -0.0700 3.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 0.9570 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 -0.6120 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7500 -1.8270 1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0920 -1.1840 1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -0.7680 2.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6190 -0.7330 4.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5580 -1.3300 6.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0840 -3.3480 6.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9690 -4.2590 5.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 -6.7800 5.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1080 -7.5320 3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -0.4910 1.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 -2.0310 2.5860 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 47 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 48 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 7 48 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 M END