IBS-ZINC05219349 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -2.1490 0.0340 0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -0.5680 0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 -0.4630 1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -1.3060 0.3490 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 -1.6080 0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 -2.4640 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 -3.0610 -1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -2.7660 -1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -1.8560 -0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 0.2890 2.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -0.1340 3.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 1.6570 2.4470 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2180 2.6820 2.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 3.0810 4.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 3.7850 4.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 2.4640 4.7030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 1.7180 3.8250 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6740 0.7140 4.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 2.3690 3.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0880 1.6190 4.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3600 2.1920 4.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4970 3.5170 3.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3840 4.2820 3.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 3.7110 3.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7170 4.0660 3.5570 F 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 2.5350 6.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 1.5350 6.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 1.6240 9.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 1.0440 8.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9380 3.1140 1.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 1.0780 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9380 -0.5030 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3820 -0.0170 1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 -1.1350 1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 -2.7240 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 -3.7530 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -3.2070 -2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 0.5790 4.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2440 1.6120 4.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5130 5.3170 2.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 4.3310 3.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 3.5540 6.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 2.3660 6.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 0.5050 6.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 1.6000 6.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 0.5860 8.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 2.3180 8.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 1.8480 10.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2440 1.2980 8.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 -0.0220 8.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 1.3410 10.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 1.9600 1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 1.8280 8.3580 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4520 2.8200 8.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -1.4180 -0.7220 N 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 2 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 10 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 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 55 2 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 30 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 53 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 53 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 53 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END