IBS-ZINC04026739 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.4350 1.5880 -0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 0.1360 -0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -0.4470 0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -1.8100 1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -2.6160 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -2.0220 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -0.6670 -1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -2.7330 -2.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -4.0710 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -4.6270 -0.8730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -4.8040 1.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -6.0780 1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -6.9180 2.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 -6.4220 3.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -7.2290 5.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -8.5640 4.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -9.0900 3.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -8.2630 2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -8.7410 1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -10.0020 1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -10.9530 2.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -10.5180 3.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 -6.6770 6.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -7.4690 7.4390 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4970 1.7080 -0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 2.0050 -1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 2.1700 0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 0.1600 1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -2.1950 2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 -0.2460 -2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -3.6460 -2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -4.3180 2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -6.5780 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 -5.3930 4.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -9.1970 5.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -10.4120 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 -9.8650 1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 -10.6330 3.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -11.1710 4.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -5.4590 6.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 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 22 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 2 0 0 0 0 M CHG 1 24 -1 M END