IBS-ZINC05091724 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 60 0 0 1 0 0 0 0 0999 V2000 0.0040 1.6150 0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 0.1120 0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -0.2050 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 -1.9700 0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 -2.4550 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4430 -2.1430 -1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3560 -0.6110 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9230 -0.1090 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 -2.8400 -2.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 -4.2980 -2.0990 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2450 -4.7610 -1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 -4.6770 -3.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8760 -3.3560 -4.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9370 -2.3450 -3.4090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9870 -3.1850 -5.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 -2.0150 -6.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2890 -2.2060 -7.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0530 -3.5170 -8.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7830 -4.5010 -6.7250 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3590 -4.6890 -1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7920 -6.0190 -1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0750 -6.3740 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9400 -5.4100 -0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5230 -4.0830 -0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2220 -3.7350 -1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8480 -2.4250 -0.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2870 -3.0680 -0.1710 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6480 -3.3590 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 2.0180 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 2.1610 -0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 1.8340 1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 -0.3530 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 0.1360 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -1.2790 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 0.3000 -1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -2.1440 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -2.4620 -0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7930 -3.5270 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3370 -1.9850 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8530 -0.3060 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9290 -0.1100 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -0.5390 -2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 0.9810 -1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 -4.9510 -3.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2970 -5.4560 -3.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -1.0610 -5.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4830 -1.4220 -8.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0250 -3.9450 -9.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1370 -6.7940 -2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4030 -7.4080 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9280 -5.7320 -0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1810 -3.7070 -0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7270 -4.0820 0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1240 -2.4310 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 -0.4760 0.1090 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8680 -0.0520 0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 55 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 55 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 8 55 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 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 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 2 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END