IBS-ZINC02452679 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 55 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 -0.7730 -1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 -0.6300 -2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6920 -0.9710 -3.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9490 -1.4350 -3.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3220 -1.5810 -1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3840 -1.2440 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4340 -1.2740 0.7050 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0680 -0.7840 1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6730 -0.6580 2.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4730 -0.3780 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7920 -0.8040 1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8480 0.0880 1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1450 -0.3630 1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4030 -1.7010 1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3640 -2.6080 1.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0600 -2.1670 1.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 -3.0840 1.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 -2.6330 1.1970 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 -3.6720 1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -3.8050 1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -5.0440 1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 -6.1110 1.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9670 -6.0070 2.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5610 -4.7650 1.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8320 -4.3390 1.9400 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8360 -1.7540 -4.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4010 -1.5840 -5.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -0.2680 -2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 -0.8710 -4.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3020 -1.9420 -1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2380 0.5280 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6590 1.1340 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9660 0.3350 1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4220 -2.0370 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5650 -3.6520 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -2.9790 0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -5.1830 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -7.0560 2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 -6.8480 2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 -0.5400 -5.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 -2.2100 -5.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2020 -1.8740 -6.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 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 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 21 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 28 2 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 29 30 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 M END