IBS-ZINC04993434 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 0.0090 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -0.6580 1.1230 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 0.0350 2.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -0.6440 3.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -1.8600 3.4980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 0.0840 4.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -0.4680 6.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 0.6280 6.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 1.7250 6.2010 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 1.4400 4.9490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 2.0900 4.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 0.5610 8.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 -0.2500 9.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 -0.3180 10.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 0.4070 11.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 1.2440 10.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.3200 9.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 2.1500 8.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8290 2.8670 9.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 2.7880 10.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 2.0020 11.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -0.7340 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -0.0320 -2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -0.7180 -3.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -2.1000 -3.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 -2.8070 -2.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -2.1290 -1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -4.1650 -2.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 1.8300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 1.8880 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 1.8790 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 1.0050 2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -1.5160 6.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 -0.8350 8.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -0.9570 10.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 0.3390 12.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 2.2210 7.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5460 3.5060 8.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 3.3660 11.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 1.9510 12.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 1.0480 -2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -0.1740 -4.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -2.6320 -4.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -2.6780 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -4.5890 -2.5240 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 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 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 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 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 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 45 1 0 0 0 0 29 46 1 0 0 0 0 M END