IFLAB-ZINC04941767 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 2.9560 7.3850 -1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8590 8.4290 -0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6140 8.6560 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4670 7.8380 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 6.7920 1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 6.5630 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8890 5.5020 0.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 4.2590 0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 3.5280 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 4.3490 -0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 5.5380 -0.4970 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 3.7090 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 2.2320 0.3890 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 2.1120 0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2340 3.8050 1.2040 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5460 2.4940 1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8820 1.7240 0.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 1.9890 1.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3720 2.7590 2.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0200 0.6780 1.9460 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1600 0.1820 2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9530 -1.2990 3.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1440 -1.8170 3.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4270 -1.6470 3.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6340 -0.1660 2.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4440 0.3520 1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7490 9.9700 0.1860 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.3630 7.2110 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 9.0690 -1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0580 8.0170 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4500 6.1540 2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 4.3880 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 3.4170 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 1.4140 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 1.8110 1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 4.4320 1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 0.0620 1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2420 0.7480 3.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0380 -1.4200 3.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8710 -1.8650 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2260 -1.2510 4.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9960 -2.8720 4.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2750 -2.0160 3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3450 -2.2130 2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7160 0.4000 3.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5490 -0.0450 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3620 -0.2140 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5920 1.4070 1.6760 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END