IBS-ZINC04863091 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 50 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -0.9510 -0.5330 1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -1.8790 1.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -2.2020 2.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -2.6270 3.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 -3.5180 3.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -2.0140 5.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -2.4750 6.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -1.4520 7.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 -0.9160 7.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6550 0.4030 7.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 1.0800 7.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 2.4120 6.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 2.9790 5.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7790 3.9720 4.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 3.4530 3.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 4.1420 2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 5.1460 2.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9430 3.6640 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 3.3580 0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 2.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -0.3660 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -0.3550 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 0.1780 1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 -0.6620 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 -2.6590 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -1.8280 1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -1.3160 3.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -3.0100 2.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -3.4340 6.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 -2.5900 5.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -0.6460 7.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 -1.9380 8.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 0.9830 7.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7360 0.3480 8.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6800 1.1120 7.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2610 0.5150 6.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2950 3.4970 6.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 2.1860 5.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 4.1140 5.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3050 4.9270 4.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3230 4.4390 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5420 2.7610 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 3.2540 1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 4.1730 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 1.3170 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 2.2420 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 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 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 M END