IFLAB-ZINC04939860 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 0 0 0 0 0 0999 V2000 -0.2160 1.4850 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 0.0120 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -0.7920 0.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.1320 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -2.9710 0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -4.3320 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 -4.8700 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -4.0230 -0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -2.6630 -0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 -6.3280 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 -7.0630 -0.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -6.8440 -0.9180 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -8.2310 -0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -8.7890 -2.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -10.1580 -2.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 -10.9810 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -10.4310 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -9.0500 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 -11.3130 0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -12.6890 0.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -13.4700 1.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 -12.8380 2.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -11.5270 2.8050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -10.7990 1.8900 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -13.5820 3.8730 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7010 -12.7220 4.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -13.5870 5.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 -15.2080 5.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -14.3430 4.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0190 -15.1340 7.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 1.7810 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 1.6260 1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 2.0980 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 -0.1280 -1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 -0.2840 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8580 -2.5550 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6540 -4.9830 0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -4.4350 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -2.0070 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -6.2540 -1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -8.1500 -2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 -10.5870 -2.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -12.0510 -1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -8.6180 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -13.1270 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 -14.5380 1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 -12.0120 5.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 -12.1790 4.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9590 -12.9480 6.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0830 -14.2780 5.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2710 -15.9170 5.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -15.7510 6.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -14.9820 3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -13.6520 5.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7330 -15.8340 7.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5380 -14.4640 8.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -15.6860 8.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3930 -14.3470 6.5740 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 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 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 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 38 1 0 0 0 0 9 39 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 40 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 58 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 58 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 M END