IBS-ZINC05047162 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 36 0 0 0 0 0 0 0 0999 V2000 0.0970 1.4050 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 0.0530 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -0.7110 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 -0.0940 0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 1.2600 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 2.0080 0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 2.0280 1.8130 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -2.1530 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 -2.8080 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -4.2490 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -5.0440 -0.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9320 -4.6380 -0.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8850 -3.6720 -0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 -2.1120 -0.1800 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0680 -4.2340 -0.4510 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9210 -5.5630 -0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6460 -5.8590 -0.5040 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0270 -6.5420 -0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3490 -6.1030 -0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3750 -7.0180 -0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0920 -8.3690 -0.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7810 -8.8110 -0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7480 -7.9040 -0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4350 -10.5080 -1.0300 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 1.9960 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 -0.4160 -0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 -0.6770 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 3.0680 1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -2.6920 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5710 -5.0490 -0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3990 -6.6780 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8980 -9.0810 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7250 -8.2500 -0.7430 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 8 9 2 0 0 0 0 8 29 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 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 30 1 0 0 0 0 20 21 1 0 0 0 0 20 31 1 0 0 0 0 21 22 2 0 0 0 0 21 32 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 33 1 0 0 0 0 M END