IBS-ZINC02139791 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 41 0 0 1 0 0 0 0 0999 V2000 -0.0810 1.3040 -0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -0.0660 -0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -0.6750 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 0.0830 -0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 1.4580 -0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 2.0660 -0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7490 -0.5770 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3380 -1.0600 -1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9640 -1.8620 -1.1520 P 0 0 0 0 0 0 0 0 0 0 0 0 5.7220 -3.1360 -0.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3710 -2.2940 -2.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6010 -3.1860 -3.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9050 -3.4540 -4.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0880 -4.4120 -4.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4100 -4.6280 -6.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 8.5160 -4.9060 -6.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5190 -5.6710 -6.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3890 -5.1030 -7.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9180 -0.7900 -0.6760 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0450 1.7770 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -0.6610 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 -1.7450 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2310 2.0600 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 3.1330 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4400 0.1230 0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -1.4190 0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 -1.7810 -1.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 -0.2220 -2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 -2.7980 -3.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5130 -1.3580 -3.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4610 -2.7060 -2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4300 -4.1310 -2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0170 -3.8810 -4.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1070 -2.4970 -4.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9720 -4.0280 -4.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8490 -5.3760 -4.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4200 -6.8280 -6.0280 O 0 5 0 0 0 0 0 0 0 0 0 0 9.8980 -3.3240 -6.7830 N 0 3 0 0 0 0 0 0 0 0 0 0 10.7690 -3.7040 -7.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2320 -2.6310 -6.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2790 -2.9250 -7.4910 H 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 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 38 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 38 41 1 0 0 0 0 M CHG 1 19 -1 M CHG 1 37 -1 M CHG 1 38 1 M END