IBS-ZINC05034986 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.8160 2.1430 -0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 0.7900 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 0.4000 1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -0.9860 1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -1.4340 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -0.3360 -0.7880 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -0.3650 -2.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -0.1390 -3.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -0.5230 -4.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 -0.2810 -5.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 0.3590 -5.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 0.7380 -3.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 0.4970 -2.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 0.6480 -6.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 0.2770 -7.2290 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1200 -2.8050 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -3.7870 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 -5.1010 -0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -5.4450 -1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -4.4760 -1.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -3.1610 -1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 2.8930 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 2.4450 -1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 2.1590 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 1.0490 2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -1.6030 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -1.3350 -2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 0.3980 -2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -1.0090 -4.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -0.5850 -6.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 1.2400 -3.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 0.8250 -1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 -3.5330 0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -5.8550 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -6.4680 -1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 -4.7420 -2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -2.4220 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7420 1.2460 -5.5970 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 38 2 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 M CHG 1 15 -1 M END