IBS-ZINC05205677 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 0.1060 1.4640 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 0.0050 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -0.8250 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -0.6080 2.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -1.6750 3.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -2.9740 2.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -3.2060 1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -2.1310 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 -2.0340 -0.7160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -0.7850 -1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -0.2870 -2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 -0.2420 -3.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 0.5290 -5.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 0.4920 -6.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -0.3850 -6.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -0.8050 -5.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -4.0510 3.7660 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -3.8960 5.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 -2.8530 5.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -4.9920 5.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -6.1920 5.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -7.2120 6.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -7.0530 7.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -5.8730 8.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 -4.8340 7.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -3.6710 7.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 -3.5830 9.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 1.7380 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 1.8810 -0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 1.8600 0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 0.3960 2.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -1.5040 4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -4.2150 1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -0.9590 -3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 0.7140 -2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 0.4300 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 -1.2430 -3.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 -0.2380 -4.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 1.5140 -4.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7830 1.4980 -7.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 0.0440 -7.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 0.1900 -7.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -1.2640 -7.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 -0.8230 -5.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -1.7810 -5.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -4.9080 3.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -6.3200 4.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -8.1390 6.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -7.8580 8.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -5.7570 9.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5890 -4.3600 9.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -3.7150 9.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 -2.6040 9.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 0.2440 -4.5320 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 54 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 M END