IBS-ZINC06645698 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -0.0140 1.5080 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0010 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 -0.6990 1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 -1.6400 -0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -2.3260 -1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -3.4860 -1.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 -3.9640 -2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1230 -3.2840 -1.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8800 -2.1240 -0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9110 -1.4580 -0.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2180 -2.0130 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 -5.2290 -2.8860 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4060 -5.4470 -2.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 -5.0460 -4.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 -6.3710 -2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -6.4570 -2.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -7.6390 -1.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 -7.9260 -1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 -8.3600 -1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 -7.5950 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4630 -8.0800 -1.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6780 -9.2960 -0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 -10.0530 -0.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -9.5970 -0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 1.8890 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 2.0070 -0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 1.7020 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 -0.1930 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -0.3180 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 -0.5060 2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -1.7730 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -1.9540 -1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -4.0190 -2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1310 -3.6600 -1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4650 -2.0600 -1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2400 -3.0170 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9450 -1.3850 0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 -4.1660 -4.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 -4.9160 -4.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 -6.4120 -5.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -5.7060 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2980 -7.4960 -1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6850 -9.6710 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7960 -11.0120 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -10.1930 -0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 -6.2320 -5.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -6.1360 -6.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 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 39 1 0 0 0 0 15 40 1 0 0 0 0 15 47 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 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 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 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 25 46 1 0 0 0 0 41 47 1 0 0 0 0 47 48 1 0 0 0 0 M END