IBS-ZINC02124268 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 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2040 3.5210 1.1900 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9900 2.8220 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5050 3.2700 0.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4180 3.5070 -0.7690 N 0 3 0 0 0 0 0 0 0 0 0 0 5.1920 3.5180 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 3.7310 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 3.7180 -2.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5450 3.7140 -1.6010 O 0 5 0 0 0 0 0 0 0 0 0 0 5.0900 4.9450 1.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0410 5.6870 1.5890 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 5.6880 3.9430 -3.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 5.3900 2.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 6.3110 2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3600 4.0790 -4.4530 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