IBS-ZINC05197854 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -1.7820 0.8120 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -0.3120 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -0.7620 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -1.8000 0.5910 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -2.6050 1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 -3.5670 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 -3.7420 -1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -2.9370 -1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -1.9450 -0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -1.0440 -0.9240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -0.2600 2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 -0.4780 3.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 0.4590 2.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 0.9120 4.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 1.6300 4.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 2.1480 4.9930 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 1.6240 2.7860 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 0.9000 1.9360 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9400 0.0300 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 1.8120 0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 1.3600 -0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 2.1950 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 3.4840 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 3.9380 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 3.0980 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 5.1980 0.4820 F 0 0 0 0 0 0 0 0 0 0 0 0 4.6600 2.2370 2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7940 1.2160 2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4640 2.9080 2.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1090 0.8210 1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 0.7460 5.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 1.7620 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 0.6700 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1880 0.8160 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 -2.4760 2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 -4.2010 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3570 -4.5080 -1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -3.0620 -2.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 0.3530 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 1.8410 -2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 4.1370 -1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 3.4490 2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5550 2.5570 1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8880 3.1000 2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8980 0.8950 3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5660 0.3530 1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6130 2.5030 3.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6910 3.6750 2.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3970 3.3450 2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8040 0.0720 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2810 0.3410 2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0280 1.3030 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 -0.0960 4.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0500 1.8300 1.9910 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 31 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 20 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 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 54 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 54 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 54 1 0 0 0 0 M END