IBS-ZINC05180647 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3060 0.0090 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 1.3170 -0.7400 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -1.6760 1.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -2.4670 1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 -2.3650 0.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5930 -3.1110 0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6580 -4.0050 1.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 -4.0850 2.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 -3.3040 2.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -4.9610 3.6170 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 -4.8750 4.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 -6.1070 5.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 -6.4600 6.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3060 -7.0460 5.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3580 -5.9890 5.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7150 -4.6930 4.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 -4.8530 1.8820 N 0 3 0 0 0 0 0 0 0 0 0 0 6.7750 -4.4510 2.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9190 -5.9520 1.3620 O 0 5 0 0 0 0 0 0 0 0 0 0 5.6510 -2.9980 -0.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8580 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8330 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -1.2910 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.0240 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -1.7400 1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 -4.0620 5.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -4.6480 3.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -5.9850 5.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 -6.9220 4.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4390 -5.5580 6.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 -7.1880 6.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 -7.7920 6.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9470 -7.5390 4.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9660 -5.7520 5.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0040 -6.4050 4.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4630 -4.1270 3.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3760 -4.0950 5.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5990 -2.3730 -1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4440 -3.5440 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 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 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 2 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 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 21 40 1 0 0 0 0 21 41 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END