IBS-ZINC02227989 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 -0.0080 1.5040 0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -0.0230 0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -0.5940 1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -2.1230 1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -2.5280 0.1970 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -1.9670 -0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 -0.4380 -0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -3.5970 -0.0530 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 -3.3640 -1.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 -3.5180 1.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 -5.2150 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 -5.7740 -1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -7.0420 -1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -7.7560 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -7.1910 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 -5.9250 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -9.0400 -0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -9.8490 -1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -9.5010 -2.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -11.1590 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -12.1070 -2.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -13.1520 -1.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 -12.8190 -0.5930 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 -13.3760 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 -11.6620 -0.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -14.4020 -2.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -14.3650 -3.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 -15.5350 -4.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 -16.7460 -3.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 -16.7930 -2.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -15.6280 -1.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -15.6740 -0.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -15.4890 -6.3620 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8890 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 1.9100 -0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 1.8000 1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -0.4080 0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -0.2290 1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -0.2780 2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 -2.5310 2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -2.4940 1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 -2.2710 -1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 -2.3250 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -0.0120 -1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -0.0750 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 -5.2190 -2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -7.4790 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 -7.7430 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 -5.4870 2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 -9.3480 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -12.0250 -3.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 -13.4230 -4.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 -17.6570 -4.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 -17.7400 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 -15.5860 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 44 1 0 0 0 0 7 45 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 47 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 29 30 2 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 32 55 1 0 0 0 0 M END