IBS-ZINC02231863 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 69 0 0 0 0 0 0 0 0999 V2000 0.0130 1.3820 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -0.1310 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -0.9050 1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -2.2600 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -2.8200 -0.1650 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -2.0130 -1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -0.6600 -1.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -2.8580 -2.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -4.1590 -1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 -4.1410 -0.5210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -5.4570 -2.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -2.3950 -3.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 -2.8550 -4.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -2.4230 -6.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -1.5310 -6.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 -1.0690 -5.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -1.4990 -4.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -3.1050 2.2690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -4.5610 2.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -5.1230 3.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 -7.1140 5.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 -8.6250 5.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 -9.3060 4.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 -8.9160 3.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -7.4190 3.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -0.1370 2.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 0.5320 2.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 1.8750 3.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 2.5120 3.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9830 1.8100 3.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9730 0.4700 3.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7650 -0.1690 2.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 1.7840 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 1.7760 -0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 1.7220 0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -5.6610 -2.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -6.2830 -1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 -5.4500 -3.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 -3.5380 -4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -2.7790 -6.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -1.1950 -7.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -0.3710 -5.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 -1.1260 -3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -2.6460 3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 -4.8940 1.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -4.9550 1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -4.9170 4.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 -4.6750 4.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -6.5850 5.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 -6.8490 5.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -8.9860 6.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 -8.8890 4.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -9.4880 2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -9.1880 2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 -7.1550 3.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -7.1190 2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 0.6050 2.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -0.7700 3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 2.4400 3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 3.5560 3.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 2.3070 3.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9110 -0.0750 3.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 -1.2150 2.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -6.6270 3.7050 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8090 -6.8280 3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 64 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 21 64 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 25 64 1 0 0 0 0 26 27 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 29 60 1 0 0 0 0 30 31 2 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 62 1 0 0 0 0 32 63 1 0 0 0 0 64 65 1 0 0 0 0 M CHG 1 64 1 M END