IFLAB-ZINC05259164 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 0 0 0 0 0 0999 V2000 0.4470 -1.5830 1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 0.5110 2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 1.6760 2.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2310 1.1630 3.3160 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8380 0.2130 2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 -0.9630 2.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 1.5710 4.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1710 1.5040 4.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6990 1.9330 5.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 2.4240 6.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5270 2.4820 6.6960 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0160 2.0630 5.4790 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 2.9190 8.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4300 2.4230 8.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8200 2.9080 10.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0700 3.8970 10.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 4.4110 10.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5430 3.9170 8.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2020 5.4050 10.8960 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0320 6.0450 10.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 5.8510 9.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 7.0610 11.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 7.6900 11.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 8.6220 11.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 9.1960 11.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 10.1620 12.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 10.5610 13.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 9.9940 13.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 9.0260 13.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -2.1600 2.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -1.1500 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -2.2010 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 0.8700 2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -0.0600 3.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 2.3650 3.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 2.2500 2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7790 -0.2080 2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0590 0.7270 1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 -1.5600 3.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 -1.6010 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8650 1.1570 3.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7740 1.8980 6.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0300 1.6370 8.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7090 2.5080 10.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3970 4.2520 11.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6550 4.3030 8.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5920 5.6710 11.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3570 7.8040 11.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 6.5180 12.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 8.8850 10.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 10.6000 11.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 11.3120 14.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 10.3070 14.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 8.6120 13.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 -0.4560 1.7040 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6230 0.0700 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 55 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 6 55 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END