PUBCHEM-ZINC02555038 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 51 0 0 1 0 0 0 0 0999 V2000 -0.4970 1.4810 -1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 0.3110 -0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 0.7740 1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -0.6880 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -0.4400 -0.9490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 0.1330 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5230 1.2900 -0.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 -0.7960 -1.7450 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 -0.5930 -2.1520 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8370 0.2190 -1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -1.8950 -1.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6550 -2.9690 -2.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5740 -0.1770 -3.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 -1.2880 -4.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 1.1030 -3.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 0.2680 -4.0160 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4150 0.2490 -5.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7300 0.7820 -6.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8320 -0.0670 -6.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0460 0.4300 -6.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1820 1.7810 -7.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0920 2.6360 -7.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 2.1400 -6.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4200 2.1350 -7.7810 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6090 3.4980 -8.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 2.2590 -1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 1.1420 -2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 1.9500 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 1.1980 1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -0.0610 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 1.5400 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.0710 -1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -1.5590 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1290 -0.2340 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 -1.7340 -1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 -1.6460 -4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9780 -0.9320 -5.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7550 -2.1510 -4.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0330 1.9140 -3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 1.4720 -4.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6820 0.9210 -3.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2850 -0.7770 -6.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6000 0.8480 -6.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7540 -1.1200 -6.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8920 -0.2420 -7.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1510 3.6940 -7.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0370 2.8230 -6.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6390 3.6120 -8.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9430 3.7890 -8.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4800 4.1550 -7.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3500 -1.7340 -1.2180 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 4 1 0 0 0 0 2 5 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 11 51 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 M CHG 1 51 -1 M END