IBS-ZINC00543543 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 0.3760 1.6620 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 0.3940 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -0.8550 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 -2.1410 0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 -2.1270 -0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -0.8620 -1.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 0.4170 -0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6820 -2.2510 -0.3920 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -2.6980 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 -3.0510 -2.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8950 -2.6800 -0.6550 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0080 -2.5070 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 -2.9460 -1.3440 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9870 -3.6670 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8160 -1.6560 -1.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0400 -0.9730 -2.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2600 0.1600 -2.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5340 0.7820 -3.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5790 0.2770 -5.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3490 -0.8510 -5.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0760 -1.4740 -4.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2270 -3.4990 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9890 -3.2340 0.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 1.7480 1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 2.5530 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 1.6620 2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 0.3660 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -0.7970 1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -0.8960 2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -3.0000 1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 -2.2720 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 -3.0010 -1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 -0.8160 -2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -0.9080 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 1.2790 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2070 0.5470 -0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9610 -1.9880 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9640 -0.9440 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8250 -1.8610 -2.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2060 0.5550 -1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 1.6540 -3.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0090 0.7560 -5.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3790 -1.2510 -6.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6640 -2.3600 -4.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1850 -4.1340 -0.8760 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 7 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 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 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 M CHG 1 45 -1 M END