IBS-ZINC05428462 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2750 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -4.7710 -0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -6.1200 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -6.9480 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -8.3170 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7550 -8.8760 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8800 -8.0390 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 -6.6650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1270 -8.5750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -10.3410 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 -11.3020 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 -12.5280 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8950 -12.2190 -0.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 -11.0260 -0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -13.9150 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -11.0940 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -11.5070 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 -11.3120 0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 -10.7070 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5280 -10.2960 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -10.4920 -1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0120 -10.4640 -0.1100 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -4.6260 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -4.6360 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -6.5170 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -8.9570 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -6.0170 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4800 -8.7340 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -14.2550 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 -14.5950 -0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -13.9000 -0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -11.9780 1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 -11.6300 1.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 -9.8250 -2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -10.1750 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 M END