IBS-ZINC04957151 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 50 0 0 1 0 0 0 0 0999 V2000 -0.2510 1.1280 -0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -0.1950 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -1.0950 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -0.6630 -2.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 0.6610 -2.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 1.5560 -1.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 1.1230 -4.1270 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5410 0.3360 -5.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 2.2910 -4.3990 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5710 -2.4380 -0.7840 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -3.2630 -0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 -2.9600 -0.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -4.6330 -0.0940 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2840 -5.4150 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -4.9230 1.4220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2040 -5.9970 1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 -2.8850 1.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -2.3300 1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5240 -3.6040 0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -4.4510 -0.4890 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0110 -5.1310 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 -3.0020 -0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 -2.4390 -1.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -4.2370 2.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1880 -4.3190 1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2470 -3.6910 2.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0350 -2.9790 3.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 -2.8970 3.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 -3.5310 3.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 -2.3640 3.9780 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 1.8280 0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -0.5280 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -1.3610 -3.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 2.5910 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -2.5860 3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -2.5230 1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -1.7010 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 -1.7690 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0070 -3.4200 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2630 -3.8840 1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 -4.8750 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 -3.7550 1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 -2.3420 4.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -3.4710 3.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 -4.3570 1.8800 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 -4.6520 0.7520 N 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 15 45 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 46 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 43 1 0 0 0 0 29 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END