IBS-ZINC04870917 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 -1.9230 -2.5530 -5.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 -3.2950 -3.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 -3.1640 -2.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2550 -3.8590 -1.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 -3.7280 -0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 -2.8950 -0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4710 -2.1980 -1.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5930 -2.3300 -3.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1780 -2.7520 0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0400 -3.4410 1.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2730 -1.7790 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5950 -2.0420 0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3540 -0.7810 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5640 -0.6860 0.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5080 0.2470 0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1410 -0.2880 0.0520 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6610 -0.0850 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3430 0.3240 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0600 0.7840 0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3280 1.3460 1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8760 1.4490 3.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1580 0.9910 3.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8950 0.4330 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1500 -0.0110 2.6680 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.8840 1.6520 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8650 2.3470 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8410 3.0590 1.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2510 3.5280 2.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5020 3.0740 3.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8710 2.3640 2.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1360 -3.2660 0.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -2.7480 -5.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 -2.8560 -5.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 -1.4880 -4.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -4.5020 -1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9450 -4.2680 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3320 -1.5530 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 -1.7880 -3.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 0.7020 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 1.7040 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3030 1.8890 4.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5860 1.0710 4.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1750 2.1370 -0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8860 1.7100 -0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8870 3.2380 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6720 4.1350 3.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1080 3.2540 4.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1010 -3.2640 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 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 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 18 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 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 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 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 29 2 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 31 48 1 0 0 0 0 M END