IBS-ZINC05055042 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.0280 1.5160 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 0.0090 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -0.6940 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.0760 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -2.7550 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -2.0520 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -0.6700 -1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2620 -0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1040 -4.7900 0.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -6.3180 0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -6.7160 -0.6210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -6.2900 -1.4470 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7680 -6.6950 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 -4.7610 -1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 -6.7940 -2.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -8.3230 -2.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 -6.2250 -3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -4.7720 0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 -4.1420 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8120 -4.7070 0.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5490 -5.4210 -0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8120 -5.9870 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6780 -6.7520 -0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7470 -7.0720 0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4890 -6.4950 1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3240 -5.8370 1.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 1.8850 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 1.8860 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 1.8680 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -0.1630 2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -2.6250 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -2.5830 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.1210 -2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -4.4860 1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -4.3860 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -6.7240 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 -6.6980 1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -4.3560 -1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -4.4360 -2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 -6.4700 -3.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2820 -8.6470 -2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 -8.6820 -3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -8.7280 -2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 -5.1360 -3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 -6.5840 -4.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -6.5500 -2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 -4.4990 1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 -5.8560 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 -4.3500 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -3.0630 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2330 -5.5990 -1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5640 -7.0540 -1.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6120 -7.6680 -0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1190 -6.5500 2.1750 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 M END