CHEMBRIDGE-ZINC04987381 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8440 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -2.5710 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 -2.3760 0.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9520 -3.8340 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9090 -4.2010 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8640 -1.9780 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 -1.5140 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1500 -3.8520 1.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4700 -3.1950 1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3600 -3.8090 0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5700 -3.2060 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8900 -1.9890 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0000 -1.3760 1.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7920 -1.9810 2.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1850 -1.3430 0.7960 N 0 3 0 0 0 0 0 0 0 0 0 0 -11.9700 -1.8840 0.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4670 -0.2710 1.3010 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 -4.1410 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 -4.3320 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1520 -5.2620 1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 -3.9880 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3730 -1.8000 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8010 -1.4220 1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6490 -0.4800 0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4760 -1.5950 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8360 -3.5740 3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2610 -4.9350 1.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1110 -4.7600 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2660 -3.6850 -0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2490 -0.4250 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0980 -1.5030 2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1400 -3.4090 1.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 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 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 9 40 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 11 40 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 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END