IBS-ZINC05248924 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 43 0 0 1 0 0 0 0 0999 V2000 -0.6900 -0.6570 1.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -1.9120 0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -1.6800 -0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -2.9460 -1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -2.7250 -2.4860 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6090 -2.9630 -2.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 -3.3190 -1.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 -2.7430 -3.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7280 -2.9560 -3.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5340 -3.3910 -2.5760 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9790 -3.5900 -2.6130 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3300 -3.6700 -3.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6900 -2.4360 -1.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6080 -1.1370 -2.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5110 0.1930 -1.8370 S 0 0 0 0 0 0 0 0 0 0 0 0 8.3390 1.4890 -3.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3440 -4.9000 -1.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9020 -5.0050 -0.6820 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -2.2760 -4.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 -2.0580 -5.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 -2.0900 -4.7340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 -2.2800 -3.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 -2.0440 -3.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -0.3370 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 0.1660 1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -0.8460 2.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -2.7240 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 -2.2230 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -0.8620 -1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -1.3600 -0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -3.7650 -0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -3.2610 -1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2980 -2.7830 -4.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0780 -3.6180 -1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2510 -2.2840 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7440 -2.7050 -1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0490 -1.2800 -3.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5700 -0.8170 -2.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8300 2.3990 -2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8130 1.1820 -4.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2830 1.7100 -3.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 -1.7710 -5.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0520 -5.7120 -2.5300 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 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 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 M CHG 1 43 -1 M END