IBS-ZINC05462262 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 -0.0230 1.3830 -0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 0.0110 -1.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -0.8420 -1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -0.6820 -0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -1.9980 -1.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8580 -2.6620 -0.8020 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3390 -3.8550 -1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4490 -4.4100 -0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4700 -3.5600 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3560 -2.1760 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3360 -1.4260 0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4320 -2.0430 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5630 -3.4150 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5830 -4.1910 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6840 -5.6560 0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6420 -6.2060 1.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7380 -6.3980 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6560 -5.8630 -0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8370 -6.5910 -1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8880 -7.7900 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3700 -8.5560 0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5180 -9.9290 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1810 -10.5450 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7000 -9.7860 -1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5590 -8.4060 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3520 -10.3920 -2.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4660 -11.8160 -2.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 1.8770 -1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 1.9910 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 1.2580 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 0.1350 -2.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -1.8200 -1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7830 -0.3480 -2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -0.9670 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1010 -0.8870 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 -0.0350 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 -1.7940 -2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -2.6460 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2310 -2.2500 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8520 -4.3680 -2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 -1.6890 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2490 -0.3500 0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1910 -1.4420 1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4190 -3.8860 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8510 -8.0770 1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1140 -10.5220 1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2950 -11.6190 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9660 -7.8130 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4710 -12.2600 -2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0080 -12.1020 -1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0070 -12.1710 -2.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 14 15 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 20 1 0 0 0 0 18 19 2 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 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 M END