IBS-ZINC01464366 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 1.7730 1.3100 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -0.1440 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 -0.7840 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -2.1230 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -2.7710 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -2.0640 -1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -0.7860 -1.2080 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -2.7040 -2.4740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -4.0760 -2.6710 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9220 -4.7780 -2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -4.3280 -4.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -3.1490 -4.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 -2.1630 -3.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -1.0340 -3.8510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -2.9610 -5.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -5.4960 -4.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 -6.6030 -4.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -5.5280 -6.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -6.4750 -7.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -6.2640 -8.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -5.1840 -8.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 -4.3650 -7.2340 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -4.2150 -2.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -5.3590 -1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 -5.4870 -0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7160 -4.4710 -1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3470 -3.3280 -1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -3.1980 -2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1180 -4.6110 -0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4010 -3.4810 0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1140 -4.5350 -1.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8600 1.3900 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 1.7840 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 1.8080 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -0.2490 2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -2.6470 2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -3.8130 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 -7.3650 -4.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -7.3040 -6.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -6.9190 -9.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 -4.8760 -9.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 -6.1520 -1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0860 -6.3800 -0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0640 -2.5340 -1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7710 -2.3020 -2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2200 -5.5720 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6910 -3.5350 1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2990 -2.5200 -0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4150 -3.5820 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9130 -5.3400 -2.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1290 -4.6360 -1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0120 -3.5740 -2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 23 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 1 0 0 0 0 12 15 2 0 0 0 0 13 14 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END