IFLAB-ZINC01015818 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 0.0420 1.1980 -0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 0.1420 -1.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 -0.3030 -1.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 1.2710 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 1.7640 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.8070 0.6530 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5960 0.9910 0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8470 1.7150 0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6700 3.9100 0.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 3.1670 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2120 3.8380 0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4870 4.7120 1.9270 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8640 5.6140 1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9530 5.0910 2.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0400 5.8270 3.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3670 6.2840 3.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3900 7.0880 4.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4860 6.9970 5.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5360 7.7690 6.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4930 8.6440 7.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4010 8.7550 6.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3540 7.9840 5.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5570 9.5990 8.5920 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.0660 3.9500 3.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4560 4.4290 3.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 1.5790 -0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 -0.3230 -2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 -1.1310 -2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 2.5670 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6860 0.8320 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5540 -0.0070 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7510 1.1750 0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8300 1.8430 -0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6440 4.0620 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7620 4.8770 1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 3.7590 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4150 3.1190 2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1110 4.3990 -0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9910 3.0760 0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5810 4.1980 2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2850 5.7080 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0290 5.4150 3.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7110 6.9180 2.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3120 6.3240 5.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3910 7.6850 7.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5880 9.4400 6.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 8.0830 4.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 0.2320 -0.9100 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9200 3.1020 1.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.9790 2.9980 2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 3 28 1 0 0 0 0 3 48 2 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 4 48 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 9 49 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 24 25 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END