IBS-ZINC04811964 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7800 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.1710 0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -3.4070 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -4.5690 0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -4.5110 -0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -3.2980 -1.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1160 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7830 -1.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -0.2780 -2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -5.7760 1.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -6.9390 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.3110 2.5290 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3150 -1.1370 3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 0.1840 2.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6070 1.3400 4.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 1.9280 6.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 0.7990 7.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 0.0570 6.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -0.4760 5.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 1.3780 8.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1700 2.5760 8.6000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 0.5640 9.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 0.7560 2.6750 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -3.4530 2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -5.4260 -1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -3.2650 -2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 -0.1380 -2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -0.9940 -3.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 0.6760 -2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 -6.9480 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -6.9240 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -7.8310 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 1.0100 2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 -0.6290 2.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 0.6360 4.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7750 2.1430 3.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6830 2.6420 6.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 2.4320 6.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0890 0.1050 7.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 0.7420 6.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 -0.7750 7.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -0.9920 4.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -1.1710 5.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -0.3940 9.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7490 0.9370 10.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 1.5270 2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 0.6420 4.3070 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 14 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 29 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 M END