IBS-ZINC04561542 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 0.0040 1.5440 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 0.0140 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -0.4940 -1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -1.9590 -1.2400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -2.7860 -1.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -2.5670 -2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 -3.6410 -2.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 -4.9410 -2.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 -5.1790 -1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -4.1040 -1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 -4.0220 -0.8880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 -2.7650 -0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 -2.2880 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1830 -1.0990 -0.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8510 -3.2530 0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9480 -2.7980 1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8050 -3.7030 1.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5810 -5.0680 1.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4910 -5.5250 1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 -4.6280 0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4280 -5.9570 2.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1390 -7.3440 2.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1960 -8.1860 2.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 1.9150 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 1.9010 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 1.9050 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -0.3440 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 -0.3580 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -0.1370 -2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -0.1230 -1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 -1.5590 -2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1340 -3.4710 -3.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 -5.7720 -2.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 -6.1940 -1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1240 -1.7380 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6530 -3.3530 2.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 -6.5860 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 -4.9830 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1550 -7.5680 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1500 -7.5780 1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1800 -7.9610 2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1840 -7.9520 3.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9750 -9.2440 2.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 12 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 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 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 20 2 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 M END