IBS-ZINC03985275 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.5120 1.4880 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 -0.0110 0.0270 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2070 -0.2950 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -0.4890 1.2030 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1290 -0.3460 2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -2.0240 0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 -2.4330 0.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 0.1290 1.2740 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 1.3690 1.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 2.0690 2.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7430 1.7680 1.7030 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2590 1.0550 2.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 1.5790 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7520 2.0770 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7970 1.5110 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1030 1.9810 0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3770 3.0140 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3480 3.5800 -0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0410 3.1140 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9010 3.1260 2.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 3.2290 3.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8650 2.2750 4.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5990 4.5800 4.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1460 4.7780 5.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2530 6.0710 5.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8160 7.1600 5.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2710 6.9600 3.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1640 5.6640 3.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6130 5.4540 2.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2890 6.2360 1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4570 4.2200 1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9430 4.1480 0.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 -0.6500 0.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -1.6120 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 2.0610 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 1.7340 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 1.8200 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6950 -0.5060 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3410 0.5120 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 2.0360 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6010 0.7010 1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9090 1.5410 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3940 3.3770 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5630 4.3830 -1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2460 3.5670 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4900 3.9330 5.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 6.2280 6.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 8.1670 5.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 7.8180 3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -2.6360 0.7540 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 50 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 20 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 31 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 33 34 1 0 0 0 0 M CHG 1 50 -1 M END