NCID-ZINC06004045 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 -0.2660 1.5140 -0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 0.1780 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -0.5210 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 0.0890 0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 1.4180 0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 2.1510 0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 3.5430 0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 4.5190 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 5.8970 0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 6.2020 1.5210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 6.7640 -0.6520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 8.1980 -0.4680 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0590 8.6270 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1960 8.4640 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3100 7.8050 -0.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 8.0170 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7370 8.6810 1.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5240 7.2940 -0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8050 7.3190 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8810 6.6170 -0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9300 6.5370 -2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9840 5.8800 -2.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9940 5.3120 -2.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9610 5.4000 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9210 6.0510 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9660 4.8380 0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0540 4.6540 -2.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 8.9130 -1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 8.1220 -2.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 -0.6750 1.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -1.8290 -0.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 2.0470 -1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 -0.3100 -1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 1.8920 1.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 3.7640 1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 4.3460 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 6.4860 -1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0940 8.0660 1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 9.5390 0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1770 6.7490 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1010 7.8600 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1520 6.9940 -2.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9940 5.8330 -3.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9210 6.1050 1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5580 4.4480 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9330 4.6690 -3.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 -0.1290 1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -2.0830 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 10.1710 -1.8010 O 0 5 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 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 37 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 30 47 1 0 0 0 0 31 48 1 0 0 0 0 M CHG 1 49 -1 M END