IBS-ZINC02338143 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7000 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0810 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7710 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0680 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.1710 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -4.9770 -0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -6.2880 -0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -6.2410 0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -4.9890 0.8920 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 -7.4350 1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 -7.5110 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -8.0700 -2.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -9.2090 -2.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 -9.7970 -2.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 -9.2510 -1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -8.1110 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7120 -7.5760 0.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 -4.5380 -2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 -5.1320 -3.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -4.7170 -4.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9500 -3.7140 -4.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1170 -3.1210 -2.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 -3.5310 -1.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1220 -2.0490 -2.7950 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.8010 -1.6890 -3.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2700 -1.5260 -1.7050 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6250 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6020 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1410 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 -7.7070 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -7.1870 2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 -8.2730 1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -7.6130 -2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -9.6420 -3.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 -10.6880 -3.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3390 -9.7140 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 -6.9220 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 -5.9140 -3.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 -5.1760 -5.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5540 -3.3930 -5.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 -3.0710 -0.9300 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 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 21 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 44 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 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END