IBS-ZINC04039263 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.1360 1.4890 -1.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 0.0190 -1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 -0.6660 -0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -2.1000 -0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 -2.7210 -0.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -2.7210 -0.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 -2.0360 -0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -0.6840 -0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 -0.0660 -0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7680 -0.7710 -0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7330 -2.1200 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 -2.7790 -0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 -4.2320 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8310 -2.8860 0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1130 -2.2480 0.1700 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.9830 -1.3160 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0230 -3.1440 0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9900 -2.5710 1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8400 -3.3770 2.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7390 -4.7650 2.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7930 -5.3480 1.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9430 -4.5440 0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7740 -1.9880 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8920 -2.9720 -1.9930 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4770 -0.1120 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 1.9860 -1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 1.6380 -2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7010 2.0290 -0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 0.9800 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7020 -0.2250 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -4.3270 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 -4.7980 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 -4.7110 -0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0890 -1.4890 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5850 -2.9200 3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4030 -5.3920 3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7180 -6.4300 1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2210 -5.0090 0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0120 0.0510 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0610 -0.8090 -1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 0.8270 -1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1210 -0.7800 -1.3930 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 8 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 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 M CHG 1 42 -1 M END