IBS-ZINC04029333 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 0.4930 0.3380 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 1.9520 2.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 3.1830 3.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 2.8630 2.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 3.6070 3.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9170 3.2820 3.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3030 2.2500 2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3690 1.4950 1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 1.8370 1.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 1.0970 1.0990 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0410 0.0320 1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 1.2880 -0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 2.6900 -0.9840 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6100 2.6060 -2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8430 3.7340 -0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1230 3.5350 -1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1440 4.4690 -1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8990 5.6260 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6320 5.8520 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 4.9180 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 3.0810 -0.4180 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6280 0.4210 0.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9850 0.0740 0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6600 2.1130 2.4710 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0720 3.1750 3.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 3.9120 3.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -0.5160 1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 0.7090 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 0.0680 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 2.2080 2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 1.1360 3.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 3.5360 4.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 3.9920 2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 4.4150 4.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 0.5830 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0980 0.9800 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3430 2.6440 -1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1290 4.2920 -1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6920 6.3540 -0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 6.7590 0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 5.1300 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 3.8180 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4790 -0.2590 1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5250 0.8950 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9890 -0.7700 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7150 3.8650 2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6510 2.7440 4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 1.4440 1.4520 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2510 2.2370 0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 48 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 48 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 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 34 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 48 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END