IBS-ZINC02295545 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 1 0 0 0 0 0999 V2000 1.3980 -0.7510 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 -1.8710 0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8320 -2.7670 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 -1.3450 2.0310 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4790 -2.1710 2.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1630 -0.2140 2.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 0.9440 2.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -0.8700 2.7300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 0.1460 2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -1.6740 3.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -2.9000 3.3330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -0.8940 4.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -1.0930 5.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 -0.4600 6.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 -0.6660 6.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 -0.0870 7.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7110 0.6950 8.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 0.9040 8.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 0.3260 7.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6350 1.1860 9.1710 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 1.9250 10.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9380 0.0180 3.4150 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 0.1370 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7490 -0.6600 1.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 1.3140 1.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 1.1860 0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5130 2.2750 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4300 3.4920 0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5850 3.6280 1.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8230 2.5420 2.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 -0.1460 -0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -1.1730 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -0.0850 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 -2.4990 0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7430 -2.2040 -0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 -3.5700 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -3.2340 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 -1.7860 5.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8410 -1.2910 5.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3130 -0.2600 7.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 1.5070 9.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 0.4950 7.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9930 2.2140 10.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4730 1.3110 10.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 2.8420 9.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 0.6350 4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8170 0.2400 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1670 2.1740 -0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0190 4.3410 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5090 4.5840 2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 2.6840 3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 -0.5790 1.7700 O 0 5 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 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 52 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 38 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 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 M CHG 1 52 -1 M END