IBS-ZINC02127846 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.0560 1.3880 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -0.0060 -0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -0.6920 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 0.0240 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 1.4110 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 2.1000 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6390 2.1340 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 3.3610 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8020 1.3560 -0.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8150 -0.0350 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8350 -0.7220 -0.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -0.6520 -0.1980 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6110 -1.6630 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0870 2.0530 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 2.2910 1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8660 3.0500 1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3130 3.3170 2.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6350 4.0860 2.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1200 4.3630 4.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4050 4.1520 5.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3960 4.8870 4.4570 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2580 5.3030 3.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1960 6.3040 4.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4030 5.7310 5.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0530 5.0870 5.7620 C 0 0 3 0 0 0 0 0 0 0 0 0 11.4220 5.7630 6.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3750 3.8070 6.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5660 2.7490 5.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 1.9180 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -0.5590 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -1.7770 -0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 3.1860 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8450 1.4660 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9960 3.0130 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7690 2.8590 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6390 1.3300 1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6380 2.4710 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7630 4.0030 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5380 3.8880 3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4240 2.3660 3.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4040 3.5110 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5090 5.0480 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7980 4.4190 3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6930 5.7380 2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1320 6.4270 3.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7090 7.2840 4.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2160 4.9950 5.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6830 6.5060 6.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4570 3.9890 7.8280 O 0 5 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 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 14 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 M CHG 1 49 -1 M END