IBS-ZINC05197864 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -2.8850 -0.1830 3.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0160 -1.0410 3.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -1.0320 3.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 -2.1000 2.1770 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -2.5910 1.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -3.6380 0.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -4.2320 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 -3.7620 0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -2.6550 1.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 -2.0280 2.3930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 -0.1550 3.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 -0.5560 4.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 1.2910 3.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 2.1660 4.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 3.5150 3.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 4.5520 4.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 3.3450 2.5970 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 1.9420 2.2180 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3860 1.7230 2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 1.5990 1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 1.1220 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 0.7840 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 0.9180 -1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6430 1.3860 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 1.7250 1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 1.5200 -0.1110 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 4.4480 1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 5.1020 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 7.1810 0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 6.2780 -0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 1.9410 5.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1440 0.7370 3.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 -0.7040 4.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 0.0830 4.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 -2.1060 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 -4.0590 0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -5.0740 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 -4.2090 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 0.9970 -0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 0.4100 -2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 0.6570 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 2.0780 1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 4.0770 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 5.1920 2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 5.3200 1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 4.4620 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 6.5950 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 7.3350 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 8.1480 -0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 5.8630 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 5.6220 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 7.2730 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 2.8190 6.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 6.4230 0.4280 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1790 7.0030 1.1070 H 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 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 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 31 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END