IBS-ZINC05078282 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 0.8300 2.5760 -0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 1.1730 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 0.9240 1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -0.3780 1.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -1.3900 0.9830 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -1.2100 -0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 0.0890 -0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -0.0510 -2.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -1.3160 -2.3560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.0590 -1.2240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -3.4440 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -4.1070 -1.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -5.4720 -1.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 -6.1930 -0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -5.5230 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -4.1580 -0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 -7.6550 -0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -8.2360 -1.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 1.0670 -3.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 1.8230 -3.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 0.4850 -4.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 2.0270 -2.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -0.6410 3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 2.8380 -0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 2.6350 -1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 3.2700 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 1.7370 1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -3.5500 -2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 -5.9860 -2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 -6.0770 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -3.6410 0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 1.2040 -3.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 2.7480 -3.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 2.0560 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 -0.0540 -4.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 1.2930 -5.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -0.1990 -4.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 2.1100 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 3.0090 -3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 1.6460 -2.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -0.5860 3.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 -1.6340 3.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 0.1070 3.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -8.3480 0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -9.3050 0.0740 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 38 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 43 1 0 0 0 0 44 45 1 0 0 0 0 M END