IBS-ZINC05206889 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 0.0640 0.9780 -0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -0.5450 -0.2880 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7920 -0.9970 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 -0.9470 0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 -0.3360 0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1950 -0.6420 -0.2540 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4810 0.1420 -0.3230 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4260 0.8260 -1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7720 0.9340 0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9180 1.0180 1.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 0.4110 1.9140 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3120 1.8130 3.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0440 1.6490 0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2210 2.6570 0.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0200 1.1910 1.8040 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2770 1.7920 1.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4160 3.0860 1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6690 3.6700 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7460 2.9380 1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5350 1.6580 2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3270 1.1280 2.2440 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6190 -0.8180 -0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3590 -0.7440 -1.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4020 -1.6240 -1.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7070 -2.5820 -0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9630 -2.6550 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9240 -1.7690 0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7330 -3.4490 -1.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 -0.4350 -1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 0.1820 -2.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -1.0270 -1.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 1.4320 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 1.2660 -1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 1.3230 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -0.5750 1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -2.0330 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4520 -1.7010 -0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 2.8380 3.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 1.3630 4.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3980 1.8110 3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8480 0.4430 2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5560 3.6260 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8080 4.6730 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7380 3.3650 1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3700 1.0850 2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1210 0.0020 -2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9800 -1.5660 -2.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1980 -3.4000 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3470 -1.8220 1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5860 -3.1350 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 -2.1150 -1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -0.7050 -2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 11 2 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 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 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END