CHEMBRIDGE-ZINC02988839 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.6890 1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.1040 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.7430 2.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7380 -0.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -3.7070 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0300 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6150 -2.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6850 -1.1850 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -0.1940 -2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 0.0440 2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -0.0710 3.2420 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 0.8540 4.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7200 0.8510 5.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6840 0.2830 5.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 1.4790 6.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0930 1.4350 7.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0020 2.1880 8.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9580 2.7110 9.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1810 2.2890 9.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1010 2.9870 10.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2100 3.0780 11.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4000 2.4790 11.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4870 1.7870 10.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3890 1.6930 9.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -0.4040 3.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 1.0920 2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 0.3860 5.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 1.8820 4.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8520 1.8940 6.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 0.3980 7.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1730 3.4540 11.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1500 3.6160 12.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2650 2.5530 11.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4190 1.3220 9.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4600 1.1560 8.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 M END