IBS-ZINC05574436 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.4150 0.8760 0.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -0.3670 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 -0.7980 -0.9350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -1.8800 -1.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -2.4990 -1.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -2.3150 -2.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -1.4050 -3.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 -1.8160 -4.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 -3.1300 -4.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 -4.0460 -3.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -3.6490 -2.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 -4.6240 -1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -5.9210 -1.7970 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -6.3960 -0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -5.3820 -0.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -4.3590 -0.6930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -7.8080 -0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -8.7900 -0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 -10.1010 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 -10.4420 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -9.4720 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -8.1560 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -7.0990 1.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 0.6400 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 1.6770 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 1.1960 1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 -1.1680 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 -0.1310 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 -0.3040 -1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 -0.3790 -3.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 -1.1080 -5.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -3.4400 -5.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 -5.0690 -3.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 -8.5250 -1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 -10.8630 -1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -11.4700 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -9.7440 2.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -7.0070 1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -7.3800 2.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -6.1440 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 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 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 M END