IBS-ZINC04844010 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 53 0 0 1 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -2.5210 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -4.0510 -2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 -4.5110 -3.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -5.9340 -3.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 -6.3120 -5.1040 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4600 -5.8380 -5.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 -7.8320 -5.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 -8.1930 -6.5150 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7260 -9.4870 -6.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 -10.7080 -5.8960 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3710 -9.8200 -8.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4720 -11.1140 -8.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9820 -11.9810 -7.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1780 -11.4780 -9.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2850 -12.8190 -9.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 -13.1540 -11.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5030 -12.1610 -11.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 -10.8260 -11.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7370 -10.4820 -10.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1530 -12.4960 -13.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7040 -11.4260 -13.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3080 -5.8670 -5.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -2.1600 -3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -2.1440 -2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -4.4120 -1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -4.4280 -2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -6.3350 -2.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -6.3510 -3.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4150 -8.3050 -4.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8890 -8.1710 -5.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 -7.5010 -7.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7620 -9.1280 -8.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8510 -13.5910 -9.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0270 -14.1900 -11.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8350 -10.0570 -12.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6530 -9.4440 -10.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9050 -10.7490 -14.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4320 -10.8820 -13.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1940 -11.8300 -14.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8070 -6.2490 -4.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 M END