IBS-ZINC02098384 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 0.4230 1.6650 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 0.1510 -0.0660 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8740 -0.1350 -0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 -0.5500 1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -2.0550 0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 -2.4700 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -1.6770 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -0.2360 -0.2120 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6450 0.0600 -1.6220 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8650 1.1390 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 -0.7140 -2.1350 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6280 -0.8380 -3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 -2.1420 -1.6360 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4150 -2.8650 -2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8020 -2.2360 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 -2.3770 -1.8260 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1520 -1.2440 -1.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3440 -1.1390 -1.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2230 -0.0900 -2.0920 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4790 0.3080 -3.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4120 1.0240 -1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9600 2.7080 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3510 3.3080 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5790 4.4350 0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8790 4.9950 0.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1940 6.0620 1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -0.1670 -2.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 0.6330 0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 1.9520 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 2.1730 -0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 1.9480 1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 -0.2240 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -0.3170 2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 -2.2870 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -2.5900 1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 -3.4920 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8390 -3.2780 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 -1.6570 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3270 0.6150 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6470 1.7860 -1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2050 3.4810 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8850 2.3100 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4260 3.7060 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1060 2.5340 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5040 4.0370 1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8240 5.2080 0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1960 6.4330 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1530 5.6980 2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4720 6.8700 1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -0.0010 -3.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 1.6720 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9450 0.2930 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 0.5520 1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7410 1.6250 -1.2460 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8690 1.9550 -2.1910 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 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 M END