IBS-ZINC04687500 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.8440 1.1240 0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -0.0030 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -0.6180 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -0.1440 2.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -0.7660 3.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 -1.8660 3.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -2.3430 1.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -1.7200 0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 -3.4200 1.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9860 -3.8540 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5430 -2.4970 4.2400 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 -1.7600 5.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1310 -0.0510 5.0920 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 -2.3690 6.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5270 -1.5900 7.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1140 -2.1990 8.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4350 -3.6330 8.5610 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6690 -4.3520 7.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0580 -3.8320 6.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2270 -4.1850 9.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4660 -5.4740 9.9990 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 -6.0330 11.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8240 -5.2530 12.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -3.9070 12.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7980 -3.4100 10.7980 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 1.8950 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 1.5190 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 0.8170 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 0.7130 2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 -0.3960 4.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 -2.0910 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -4.1270 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -3.0470 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 -4.7200 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 -3.4640 4.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6110 -1.6290 7.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 -0.5550 7.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 -1.7040 9.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 -2.0660 8.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8870 -5.4180 7.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -4.1890 7.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4100 -4.2780 5.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0960 -4.0900 5.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 -7.0850 11.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -5.6830 13.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2300 -3.2710 12.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 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 19 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 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 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 M END