IBS-ZINC05147838 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -0.7310 2.3250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -1.1720 3.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -1.5220 4.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -1.5220 5.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -1.9180 6.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -2.3170 7.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -2.3220 6.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 -1.9250 5.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 -1.8350 4.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 -1.3940 3.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 -1.1370 2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 -0.7030 1.1520 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0920 -1.3370 2.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7930 -1.0640 0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2610 -1.3600 1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7580 -2.6260 0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1150 -2.8530 0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9220 -1.8170 1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4150 -0.6250 1.6030 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1300 -0.3720 1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -1.2110 4.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -1.9190 7.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -2.6260 8.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 -2.6340 7.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5860 -1.6580 2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3840 -1.6950 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6620 -0.0160 0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1030 -3.4170 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5360 -3.8270 0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9800 -1.9850 1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7520 0.6180 1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 15 2 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 23 39 1 0 0 0 0 M END