IBS-ZINC05047159 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5340 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 0.0040 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -0.5130 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -2.0430 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -2.0550 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -0.5260 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -3.9590 1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 -4.3720 1.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2850 -5.8690 1.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 -6.5400 1.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -6.4630 2.1010 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5570 -7.8600 2.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -8.6060 2.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 -9.9830 2.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7300 -10.6220 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7820 -9.8780 1.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6990 -8.5000 1.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8150 -11.9790 2.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0160 -12.5700 1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9290 -14.0690 1.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3760 -14.6910 3.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2960 -16.0660 3.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7700 -16.8190 2.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3250 -16.1980 0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4080 -14.8230 0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.9100 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 1.9010 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 1.8810 0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 -0.3440 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.1740 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -0.1320 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -2.4230 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 -2.4140 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 -2.4350 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -2.4360 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 -0.1450 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 -0.1960 -0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 -4.2720 2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -4.4360 0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 -3.8960 2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8360 -4.0600 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 -5.9220 2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -8.1090 3.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 -10.5630 3.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6680 -10.3760 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5200 -7.9210 1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8670 -12.2050 2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1440 -12.3030 0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7870 -14.1020 3.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6440 -16.5510 4.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7080 -17.8930 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9140 -16.7860 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0640 -14.3380 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 -2.5000 1.2890 N 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 6 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 54 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 54 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 7 54 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 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 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 2 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 25 53 1 0 0 0 0 M END