IBS-ZINC05451628 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 47 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3850 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 1.1820 -0.6910 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 0.0080 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 1.4220 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 2.1020 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 2.1310 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 3.3470 -0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7970 1.3860 -0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 0.0180 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 -0.6310 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1070 -0.5030 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4850 -1.7590 -0.0690 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 -2.7790 -0.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9130 -4.0700 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0960 -4.3480 -0.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9020 -5.1430 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 -4.8270 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 -5.8360 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 -7.1620 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3420 -7.4890 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 -6.4870 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6200 -6.8060 -0.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9750 0.6950 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1280 1.8080 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6820 3.0840 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0540 3.2420 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8900 2.1390 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3570 0.8650 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.5490 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -1.7710 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 3.1820 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5810 -2.5560 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 -3.7940 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -5.5900 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -7.9460 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6450 -8.5260 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0140 -6.9060 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0390 3.9510 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4780 4.2350 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9610 2.2740 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0090 0.0040 -0.0850 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 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 22 2 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 40 1 0 0 0 0 27 28 2 0 0 0 0 27 41 1 0 0 0 0 28 29 1 0 0 0 0 28 42 1 0 0 0 0 29 43 1 0 0 0 0 M END