IBS-ZINC05092239 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 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 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -0.8470 2.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.3120 3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -1.6170 4.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -1.4280 3.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8290 -1.1030 2.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 -0.6370 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9450 -0.3040 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3040 -0.4380 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9420 -0.9040 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2100 -1.2280 2.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 -1.7310 3.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9130 -3.7050 4.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5210 -5.1900 4.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0750 -5.2810 4.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 -3.8430 3.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2940 -1.0330 1.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2420 -0.0260 -1.2750 Cl 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 -1.0240 -0.7640 2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 0.0570 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9050 -1.2910 3.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3350 -1.4490 4.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7340 -3.1660 5.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9580 -3.6170 4.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1820 -5.8210 4.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5590 -5.4840 5.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0260 -5.9560 3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -5.6180 5.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 -3.8580 2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 -3.3250 4.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7610 -0.2410 1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0240 -3.1940 3.5780 N 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 2 0 0 0 0 3 9 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 39 1 0 0 0 0 19 38 1 0 0 0 0 M END