NCID-ZINC04577859 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 1.0360 1.3430 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -0.0390 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 -1.0460 1.1980 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2120 -1.9260 1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -1.8690 -0.6270 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7870 -2.8980 -0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -0.8530 -1.4150 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 -1.8480 -1.3580 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3930 -2.1990 -2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1230 -0.4200 -1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 -0.0830 -0.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 -2.7850 -0.7030 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5400 -4.1320 -0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 -4.6950 -1.8090 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5810 -4.8560 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8820 -6.1280 -0.6890 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7780 -6.9100 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0710 -8.1260 -0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9690 -9.0250 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5790 -8.7090 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2910 -7.4990 1.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3910 -6.5990 1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -0.4180 2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 0.1980 2.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 0.1110 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 1.2860 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 1.9570 -0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 1.8950 1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0630 -2.3360 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4870 -4.2390 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1500 -4.9670 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5930 -8.3690 -1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1900 -9.9670 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2790 -9.4060 1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7660 -7.2540 2.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1910 -5.6690 1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 0.7300 -0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 -0.8580 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 0.5950 1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -1.5280 0.8060 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 -0.7550 0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0220 0.2080 -2.4760 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1640 -0.5740 3.2870 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 40 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 40 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 42 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 42 -1 M CHG 1 43 -1 M END