IBS-ZINC02223428 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -1.1290 1.3510 2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 -0.0780 2.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 -0.6770 1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3490 0.0950 0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9800 -0.5120 -0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 -1.8910 -0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -2.6680 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -2.0600 1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 -4.0660 0.1100 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 -4.7530 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 -4.1510 -0.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -6.2190 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -6.9380 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -8.3140 -0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 -8.9910 -0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6450 -8.2980 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 -6.9100 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8570 -6.1200 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0840 -6.7360 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2220 -5.9890 0.2420 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4540 -6.6000 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5140 -7.9740 0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7450 -8.5680 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8780 -7.7640 0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7430 -6.4050 0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5550 -5.8660 0.4790 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.4460 -8.4590 1.1580 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 -4.6600 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7340 -3.9800 0.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 1.6990 3.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 1.7110 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 1.7320 2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 1.1730 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4260 0.0910 -1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5370 -2.3630 -1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -2.6620 2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -6.4200 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -8.8710 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 -10.0690 -0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5820 -8.8310 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1450 -7.8130 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1740 -5.0310 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6140 -8.5690 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8230 -9.6330 1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6200 -5.7750 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 12 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 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 28 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 28 29 2 0 0 0 0 M END