IBS-ZINC02355740 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 1.1880 1.2480 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.1690 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -0.8360 0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -2.2720 0.8450 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4110 -2.4350 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -3.2880 0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -3.3150 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -4.2250 1.8440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -4.3780 2.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -5.2760 3.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -3.5110 2.7650 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 -2.4890 1.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 -1.8040 1.7580 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 -3.6960 3.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6570 -2.8550 4.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 -1.8250 5.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -0.1960 2.1170 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -0.6340 3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 -1.5620 3.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8390 -1.9790 4.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 -1.4650 5.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -0.5230 5.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -0.1240 4.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 0.0460 7.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 0.8560 6.9520 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5150 1.7230 0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 1.2800 -1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 1.8430 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -0.6910 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 -4.8900 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -3.4360 3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 -4.7480 4.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7720 -3.1120 5.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 -1.2460 6.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2970 -1.5150 4.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 0.7710 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 -1.9300 2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 -2.6950 4.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -1.7930 6.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 0.5940 4.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -0.3280 8.1710 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 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 14 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 2 0 0 0 0 M CHG 1 25 -1 M END