IBS-ZINC05451277 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 -1.1880 0.6460 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 0.1980 0.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -0.4220 -0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -0.9340 -0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 -1.5930 -1.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 -1.7210 -3.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -1.2270 -3.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -0.5720 -2.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 -2.4220 -4.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 -3.6430 -4.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7520 -1.6670 -5.3770 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 -2.3680 -6.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6400 -1.9000 -6.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7570 -0.3650 -7.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 0.3090 -5.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 -0.2050 -5.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1910 0.0470 -7.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7010 0.5150 -8.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0240 0.7540 -8.1860 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7110 1.1070 -8.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2570 0.4210 -6.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1670 -0.0100 -6.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9490 0.7210 -9.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6180 -0.0550 -9.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 1.4350 -0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 -0.1860 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 1.0730 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 -0.8240 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 -2.0000 -1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -1.3510 -4.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -0.1940 -2.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 -3.4520 -6.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5280 -2.1760 -7.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3330 -2.2580 -6.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9550 -2.3880 -7.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8040 0.1110 -4.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1280 1.4000 -5.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 0.0920 -6.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 0.2470 -4.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2350 0.5140 -6.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7420 1.7900 -9.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5270 0.3890 -10.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 0.3050 -10.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 -1.1320 -9.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9450 0.1350 -8.2600 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0110 -0.2900 -8.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7920 1.1450 -8.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 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 30 1 0 0 0 0 8 31 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 16 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 M CHG 1 45 1 M END