IBS-ZINC04029167 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.3880 2.1230 -2.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 0.9750 -2.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 0.1690 -1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 0.5030 -1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 1.6630 -1.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 2.4680 -2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0810 -0.3760 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0760 -1.1670 -1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6560 -0.5080 -1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0090 -1.8300 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6910 -3.0250 0.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 -2.1870 -2.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 -1.9980 -3.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 -0.9500 -3.9930 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -3.2230 -3.9490 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7160 -4.1480 -3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -3.1210 -3.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -3.5590 -4.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -3.0790 -6.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 -3.2560 -5.4040 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 -3.4580 -6.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6190 -3.6750 -5.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 -3.3890 -7.4100 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6450 -3.5410 -8.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3360 -3.5280 -9.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4790 -2.3540 -10.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1770 -2.3470 -11.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 -3.5090 -12.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 -4.6790 -11.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8670 -4.6890 -10.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 2.7470 -3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 0.7060 -2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -0.7250 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 1.9380 -1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 3.3620 -3.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 0.2710 0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 -1.0670 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 -3.0820 -1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -3.7470 -2.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -2.0910 -3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -4.6530 -4.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -3.1460 -5.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -3.6420 -6.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -2.0110 -6.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3270 -2.7200 -7.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1280 -4.4900 -7.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8240 -1.4360 -9.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 -1.4340 -12.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 -3.5020 -13.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2060 -5.5840 -12.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.6060 -9.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 -1.1120 0.2280 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 52 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 M CHG 1 52 -1 M END