IBS-ZINC04859743 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.2720 1.0240 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 -0.4490 -0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -0.7760 -1.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 0.0290 -2.4150 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -0.4420 -3.5610 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 0.3210 -4.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 1.6210 -4.5870 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2430 -0.4970 -5.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4640 -0.0080 -5.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4020 -0.8780 -6.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5920 -0.5040 -6.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2080 -1.6770 -7.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3820 -2.7230 -7.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 -2.2240 -6.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6400 -4.1520 -7.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8080 -4.5430 -7.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0510 -5.8790 -8.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1440 -6.8380 -7.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9730 -6.4630 -7.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7230 -5.1160 -6.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0040 -7.4920 -6.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9860 -7.1630 -6.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7820 -1.8650 -5.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1880 -2.4370 -6.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 -2.4610 -4.8150 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -1.7750 -3.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -2.3480 -2.5210 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 1.2120 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 1.6500 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 1.2610 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -1.0740 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 -0.6370 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 2.1070 -4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6940 1.0420 -5.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9670 0.5010 -7.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1540 -1.7530 -7.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5210 -3.7970 -8.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9540 -6.1750 -8.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3410 -7.8820 -7.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 -4.8210 -6.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -8.7930 -6.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5870 -9.4290 -6.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 15 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 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 41 42 1 0 0 0 0 M END