IBS-ZINC02249470 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 2.2830 1.0010 -0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 -0.2490 -0.3970 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -0.9400 0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -2.0740 0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -2.0820 -0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -0.9180 -1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -0.6050 -2.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -1.4960 -3.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -2.6610 -2.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 -2.9650 -1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -3.0900 1.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -2.9320 3.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -4.2100 3.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 -5.1030 3.6960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -4.2550 4.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 -5.4520 5.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -5.5240 6.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -3.9610 7.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 -4.2120 8.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -1.7000 3.6220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 -1.4470 4.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -2.2730 5.8750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -0.0340 5.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 0.4690 6.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 1.7940 6.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 2.6140 6.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 2.1100 5.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 0.7850 4.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 0.8510 -1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 1.7570 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 1.3110 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 -0.5810 1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 0.3000 -3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 -1.2760 -4.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 -3.3420 -3.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 -3.8780 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 -4.1070 1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8030 -5.4580 5.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -6.3340 4.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -6.3570 7.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -5.6510 6.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -4.7990 8.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9230 -3.8200 7.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 -3.0360 8.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 -4.3210 7.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -5.0280 9.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -3.2410 8.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -0.9090 2.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 -0.1580 7.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 2.1870 7.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 3.6460 6.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 2.7500 4.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 0.4120 3.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -4.2520 7.3190 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3350 -3.4480 6.6550 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 6 1 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 54 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 54 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END