IFLAB-ZINC04339790 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 2.0370 1.7410 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 0.2900 1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -0.5500 0.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -1.8780 0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -2.7490 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -4.0960 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -4.5890 1.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 -3.7060 2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -2.3610 2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -6.0240 1.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -6.8540 0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -8.3210 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 -9.0380 1.8260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -8.7290 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -9.9690 -0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -10.0360 -1.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 -8.8710 -2.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -7.6330 -2.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 -7.5470 -0.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -6.4820 -0.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -6.3800 -2.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -4.8060 -3.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9710 -4.3700 -2.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3410 -4.9960 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9640 -5.4320 -0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1460 -3.4220 -0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 -8.9490 -3.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 2.0550 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 2.3820 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 1.8210 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 -0.0240 1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 0.2110 2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -2.3690 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -4.7730 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -4.0800 3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 -1.6800 2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -6.4200 2.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -10.8740 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -10.9960 -2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -5.6210 -2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 -6.6040 -3.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 -5.1670 -4.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 -3.9570 -3.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3430 -3.5520 -3.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6620 -5.2110 -2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0250 -5.8450 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2540 -4.6360 0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2730 -4.5910 -0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 -6.2500 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8880 -4.2180 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4720 -2.5810 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0330 -3.0950 0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 -8.9130 -3.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0780 -5.8820 -2.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8570 -3.9200 -1.2580 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 54 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 55 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 54 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 55 1 0 0 0 0 27 53 1 0 0 0 0 M END