IBS-ZINC00538967 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.6250 1.4570 0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -0.0720 0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -0.5030 1.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -1.8430 1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 -2.7230 0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -4.0820 0.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 -4.5810 1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 -3.6910 2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -2.3300 2.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 -1.4640 2.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2270 -2.0320 3.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9610 -0.9110 4.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -6.0260 1.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 -6.8430 0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -6.4210 -0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -5.2820 -1.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 -7.5660 -1.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 -8.6250 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -8.2060 0.6320 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -10.0460 -1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -11.0500 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -12.3750 -0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -12.7110 -1.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -11.7210 -2.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -10.3920 -2.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 1.8540 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 1.7860 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 1.8200 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 -0.4690 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -0.4350 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 -2.3400 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -4.7630 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 -4.0690 3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 -2.6640 4.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9460 -2.6320 3.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6850 -1.3440 5.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4790 -0.2790 3.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2420 -0.3110 5.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -6.4510 2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -7.6300 -2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 -10.7900 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -13.1530 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -13.7500 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -11.9900 -3.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -9.6200 -3.1110 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 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 33 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 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 38 1 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 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 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 M END