PUBCHEM-ZINC00981813 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 1.5140 2.3390 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 0.9200 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 0.4690 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -0.8320 1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -1.7240 0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -1.2720 -0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 0.0420 -0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 0.4410 -2.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -0.1160 -3.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 0.7320 -4.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 1.7490 -3.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 1.5810 -2.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 2.8210 -4.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 3.2630 -4.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 2.7150 -2.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 1.6420 -2.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1620 3.5620 -2.6520 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3300 4.6480 -3.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2080 5.4960 -3.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 4.6600 -4.6880 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0730 3.3010 -1.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5220 3.9410 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0640 5.0020 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -3.1300 1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -3.9270 0.0830 O 0 5 0 0 0 0 0 0 0 0 0 0 2.1390 2.3890 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 2.9640 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 2.7640 0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 1.1310 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -1.1570 2.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -1.9560 -1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -1.0290 -3.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 0.5950 -5.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 3.3040 -5.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0650 3.6990 -1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1700 2.2220 -1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6320 3.4840 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 5.4910 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 5.4110 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -3.4100 2.2830 O 0 0 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 2 0 0 0 0 3 4 2 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 5 6 2 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 20 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 17 21 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 2 0 0 0 0 M CHG 1 25 -1 M END