PUBCHEM-ZINC05431824 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 1.4010 -1.7620 -2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -1.7440 -1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -1.3360 -0.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -2.1810 -1.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -2.1340 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -2.6160 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4720 -1.7030 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7600 -2.2700 -0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 -3.7050 -0.2920 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0980 -3.9780 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4210 -3.5010 0.3490 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.2620 -3.7950 -0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 -2.0440 0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6740 -1.0200 0.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5200 -3.9930 1.7250 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7230 -4.0670 2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7200 -4.3420 2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7170 -4.2500 1.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8220 -4.8480 3.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2610 -5.1670 3.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8470 -6.3500 3.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1800 -6.4070 4.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6770 -5.2700 4.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4220 -4.0380 4.6500 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 -4.4380 0.4550 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7440 -4.0900 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 -0.2530 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 0.5250 -0.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 -1.3740 -2.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -2.7860 -3.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 -1.1420 -3.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -2.7750 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 -1.1090 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2180 -5.7490 3.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4600 -4.0830 4.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3210 -7.1990 3.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7730 -7.3030 4.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6940 -5.1290 4.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5130 -4.5250 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -4.5270 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 0.2100 -0.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 1.1680 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 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 24 1 0 0 0 0 23 38 1 0 0 0 0 25 26 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 27 28 2 0 0 0 0 27 41 1 0 0 0 0 41 42 1 0 0 0 0 M END