IBS-ZINC02124270 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3840 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 1.1960 -0.6900 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0120 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 1.4190 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 1.8480 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 0.7360 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -0.3710 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 -1.2890 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 3.2690 -0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4420 3.9720 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1820 3.5330 -1.2470 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0940 4.5660 -1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4940 3.2760 -0.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4320 3.5000 0.6900 N 0 3 0 0 0 0 0 0 0 0 0 0 5.2130 3.5070 1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8130 3.7080 2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 3.6920 2.8470 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5730 3.6980 1.5040 O 0 5 0 0 0 0 0 0 0 0 0 0 4.8650 2.5770 -2.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6900 1.7700 -2.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5510 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -1.7700 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 3.1740 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6040 0.7170 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7520 3.9100 3.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6660 2.6220 -2.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 1.9890 -3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4400 4.0380 4.3970 H 0 0 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 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 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 28 1 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 M CHG 1 16 1 M CHG 1 20 -1 M END