IBS-ZINC05201155 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 -4.8700 -1.0570 -2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3780 -1.0760 -1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0240 -2.1810 -0.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -2.6140 0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -1.4540 1.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 -1.8640 3.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 -2.9760 -1.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -2.6270 -1.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 -3.5860 -1.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0800 -3.2470 -1.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4680 -1.9250 -2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4670 -0.9920 -2.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 -1.3290 -2.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -0.2390 -2.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 0.8510 -2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 2.1160 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 2.5430 -2.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 3.5930 -1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 4.0000 -1.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2850 3.3440 -2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9270 2.3320 -3.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 1.9670 -3.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 0.4330 -2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 1.1140 -2.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 -4.8830 -1.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1070 -0.2550 -2.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1950 -2.0050 -2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4480 -0.8870 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 -1.2050 -2.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 -0.1040 -1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5410 -2.0080 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2930 -3.1780 -1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -2.9270 0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 -3.4790 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 -0.6070 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4160 -1.1020 1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -2.1810 3.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -1.0230 3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 -2.6910 3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 -2.7740 -2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 -4.0310 -1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8510 -4.0060 -1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -1.6470 -2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 2.9050 -2.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 4.0940 -1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7460 4.8120 -1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3330 3.6260 -2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 1.1680 -4.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 -5.4400 -1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 -2.1700 -0.6990 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2070 -1.1970 -0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 50 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 4 50 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 6 39 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 7 50 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 44 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 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 25 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END