IBS-ZINC02160404 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -2.5400 2.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -2.7860 3.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -3.2430 4.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -3.4570 4.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5280 -3.2090 3.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8560 -2.7560 2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 -3.9190 5.8270 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9420 -4.0740 5.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6640 -4.4040 6.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9210 -4.9390 6.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6100 -5.2500 7.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9600 -5.8270 7.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5810 -6.1010 9.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9130 -5.8400 10.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4780 -6.0980 11.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6810 -5.3170 10.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0090 -5.0130 9.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7360 -4.4710 9.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0640 -4.1680 8.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8130 -3.6430 8.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 -3.0150 6.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0790 -4.2100 10.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9730 -6.6730 9.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3630 -7.2930 7.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0920 -6.2650 6.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5800 -6.0890 6.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 -2.6200 3.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -3.4350 5.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5950 -3.3730 3.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 -2.5680 1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0910 -4.8790 4.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3360 -3.1440 5.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3820 -5.1200 5.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 -2.0780 6.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -2.8210 7.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3240 -3.2020 10.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9980 -4.3070 10.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4410 -4.9330 11.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6770 -5.8780 9.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0120 -7.4380 9.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4220 -7.5510 7.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7680 -8.1890 7.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5520 -5.3120 6.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5030 -6.6240 5.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1480 -6.9950 6.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3720 -5.2480 5.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 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 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 23 2 0 0 0 0 14 15 2 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 27 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 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 M END