IFLAB-ZINC04077721 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.0400 1.3450 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.0840 0.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -0.6780 -1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -2.0620 -1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -2.6640 -2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -1.8890 -3.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 -0.5090 -3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 0.0970 -2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 -2.5480 -4.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -2.7780 -5.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 -2.4390 -5.2930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 -3.3590 -6.6100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -3.5710 -7.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -3.2570 -7.5750 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -3.5210 -8.5830 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 -4.0910 -9.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -4.3080 -9.1920 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 -4.5560 -11.1120 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.9630 -4.0450 -10.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7690 -4.3800 -12.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 -4.9120 -13.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0840 -4.0900 -12.1330 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8120 -4.3120 -13.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5100 -5.3980 -14.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2300 -5.6140 -15.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2510 -4.7520 -15.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5550 -3.6700 -14.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8430 -3.4510 -13.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 1.7240 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 1.7110 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 1.6890 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -2.6680 -0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -3.7410 -2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 0.0940 -3.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 1.1740 -1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2890 -1.9030 -4.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 -3.5040 -4.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -3.6300 -6.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 -4.5700 -10.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0010 -2.9700 -10.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5270 -3.7270 -11.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7110 -6.0720 -13.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9940 -6.4580 -15.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8130 -4.9230 -16.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3530 -2.9970 -15.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0830 -2.6080 -13.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 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 45 1 0 0 0 0 28 46 1 0 0 0 0 M END