IFLAB-ZINC04586302 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -2.7410 3.4220 -0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 2.2010 -0.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7610 1.0590 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 -0.1620 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8810 -1.3220 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2550 -1.2670 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8840 -0.0510 -0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1410 1.1120 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2070 -2.7480 0.0370 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.4610 -2.4470 -0.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3590 -3.7920 -0.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5110 -3.0610 1.6340 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3050 -2.2320 2.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7930 -2.6920 3.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5640 -4.1050 3.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0510 -4.2220 2.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -4.2400 2.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9770 -4.3300 1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5810 -5.4930 0.3600 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0460 -5.6110 0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5720 -5.5090 1.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8070 -6.4340 -0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5990 -6.3250 -0.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 -7.6210 -0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 -8.6540 -1.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 -7.7110 -2.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 4.2550 -0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 3.3750 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4510 3.5680 0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -0.2060 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 -2.2730 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9580 -0.0100 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6330 2.0620 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1020 -1.1720 2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3700 -2.4410 2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8650 -2.1830 4.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5510 -2.5310 4.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 -3.3260 2.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1840 -5.1030 3.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 -3.4230 0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 -4.4480 1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4670 -4.8060 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3280 -6.5740 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2280 -6.3670 2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6620 -5.4930 1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3620 -7.9860 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4370 -8.4750 -1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 -9.6990 -1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1680 -8.1360 -2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7890 -6.9120 -2.9280 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 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 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 M END