IFLAB-ZINC04341917 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 0.9090 2.5690 -2.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 1.4260 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 1.5110 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 1.5370 -1.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 0.1430 -1.8680 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 -0.2670 -1.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 -1.5220 -2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -1.8720 -2.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -0.8740 -2.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -3.2430 -3.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 -4.1020 -2.7690 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 -2.5620 -2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9330 0.4530 -1.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 0.9140 -1.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0110 0.7420 -2.9750 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1010 1.6440 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1050 2.0390 -2.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0970 3.2070 -2.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2680 4.0860 -2.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2650 3.2410 -3.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7600 4.1640 -4.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9160 3.8770 -5.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5770 2.6790 -5.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0940 1.7460 -4.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9390 2.0190 -3.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1600 1.2860 -2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4270 0.1860 -1.9930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 2.5710 -1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 2.4320 -3.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 3.5190 -1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 2.4310 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 0.6540 0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 1.5070 0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 1.4760 -3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 0.7220 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 2.4910 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 -3.7660 -3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -3.1520 -4.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7920 -2.2990 -3.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 -2.6680 -1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8880 0.6220 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 2.5320 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5590 0.9880 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2480 5.1020 -4.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3020 4.5960 -5.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4760 2.4670 -5.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6140 0.8110 -4.0250 H 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 4 1 0 0 0 0 2 5 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 M END