IBS-ZINC05164555 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 -0.1530 0.9980 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -0.3700 0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -0.8860 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 -0.0380 0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 1.3420 0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 1.8540 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8560 -0.6160 0.1800 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7950 -1.7140 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 -0.2610 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8970 -0.7420 -2.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4420 -0.3790 -3.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5450 0.4680 -3.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1150 0.9470 -2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5720 0.5730 -1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1900 1.0640 -0.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8490 0.5620 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 -0.2280 1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5330 -0.7360 2.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4240 -0.3040 3.6890 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4620 0.5240 3.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7110 0.9640 2.1550 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2380 -0.7410 5.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6540 -2.2120 5.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5930 -4.1710 6.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 -4.8410 7.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 -5.1570 7.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7450 -3.9790 7.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 -3.2570 5.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1030 0.8530 -4.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 1.4000 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 -1.0370 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 -1.9570 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0770 2.0350 0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 2.9240 0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0290 -1.3970 -2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 -0.7590 -4.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9800 1.6020 -2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1170 0.8130 4.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8320 -0.1240 5.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1970 -0.5680 5.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5230 -2.8170 4.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7140 -2.2510 5.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5830 -3.8780 7.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6830 -4.8210 5.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2620 -5.7780 8.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 -4.2040 8.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 -4.2880 6.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 -3.3230 7.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5280 -3.9020 5.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 -2.3300 5.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6150 0.4320 -5.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 -1.5540 3.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 -1.7790 2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8780 -2.9040 6.3560 N 0 3 0 0 0 0 0 0 0 0 0 0 4.8270 -2.2700 7.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 17 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 52 2 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 54 1 0 0 0 0 29 51 1 0 0 0 0 52 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END