PUBCHEM-ZINC06473044 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.7980 0.0430 -0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -1.1430 -0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 -0.9050 -0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 0.7500 0.0670 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 1.1470 -0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 -1.8900 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 -2.3130 -1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8610 -1.7270 -2.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -3.3890 -1.9950 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 -3.8360 -1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 -4.0410 -3.2920 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0090 -3.2730 -3.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -5.1890 -3.0880 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5010 -4.6850 -2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2280 -6.0340 -1.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6820 -7.1900 -2.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 -7.7430 -3.5020 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6100 -7.0660 -3.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6270 -7.6930 -4.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -5.9820 -4.6360 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6790 -9.1250 -3.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 -8.0120 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 -7.4570 0.0780 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2360 -4.4980 -3.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -4.7290 -3.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 0.0840 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -2.1230 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 2.1680 -0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1990 -1.4730 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 -2.7660 0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 -8.2200 -3.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -8.1620 -5.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -9.1330 -2.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -9.3170 -4.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5690 -10.2260 -3.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 -11.0750 -3.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8740 -10.0070 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 -9.2000 -0.8990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -4.5360 -5.2200 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 21 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 38 2 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 M CHG 1 23 -1 M CHG 1 39 -1 M END