IBS-ZINC05249646 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 46 0 0 0 0 0 0 0 0999 V2000 0.0160 1.1060 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -0.0910 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -0.6760 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 -0.0680 0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 1.1420 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 1.7240 1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8270 1.5130 1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5550 0.4960 0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 -0.4140 0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9510 0.5960 0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5170 1.6440 1.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7900 2.5800 1.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4740 2.5280 1.7380 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7300 -0.3800 -0.0600 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1150 -0.2060 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6600 1.0670 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0330 1.2480 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8620 0.1540 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3200 -1.1260 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9550 -1.3120 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4330 -2.5680 -0.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3600 0.2790 -0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7550 1.6960 -0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0470 2.6850 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5530 2.6620 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 1.5570 1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5680 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -1.6080 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 2.6560 1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2890 3.4160 2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3140 -1.1830 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0110 1.9260 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9720 -1.9820 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2140 -2.8980 -1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8040 0.0500 0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7320 -0.4280 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8340 1.8160 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4470 1.8770 -1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2070 2.3910 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4410 3.6890 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3870 3.1060 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0170 3.2420 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 13 2 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 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 32 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END