PUBCHEM-ZINC05523613 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 41 0 0 1 0 0 0 0 0999 V2000 0.0150 2.1150 1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 0.6210 1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -0.1950 2.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 -1.6990 1.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -2.5720 2.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -4.0440 2.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 -4.9820 3.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 -6.3930 2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 -7.3320 3.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 -2.2450 5.2270 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6360 -3.0190 5.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -0.8520 5.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -2.3770 6.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -1.6300 6.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 -1.6320 7.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 2.4230 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 2.6780 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 2.3880 2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 0.3510 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 0.3870 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 0.0790 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 0.0620 3.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -1.9810 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -1.9050 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 -2.2220 2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -4.4070 2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 -4.0940 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 -4.5890 3.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 -5.0340 4.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -6.7910 2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 -6.3630 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1400 -6.9780 3.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -7.4110 4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0950 -8.3340 2.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 -0.6610 5.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 -0.7470 4.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7170 -0.0670 5.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -3.4230 6.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 -2.0010 7.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -2.4600 4.1100 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1750 -1.6990 4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -3.2900 4.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 40 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 M CHG 1 40 1 M END