PUBCHEM-ZINC05498082 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 0.1800 1.7040 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 0.1920 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -0.3880 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -0.0310 1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -0.4720 2.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 0.1110 -1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9850 1.1260 -0.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2370 -0.7030 -2.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 -1.5100 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9920 -0.5140 -3.3880 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3480 0.5130 -3.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -1.1200 -4.6630 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4660 -0.5400 -5.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 -2.1890 -4.5300 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 -1.6080 -3.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1570 -1.9340 -3.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1090 -3.4670 -5.1850 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3670 -4.2160 -4.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -3.5130 -5.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -2.0980 -4.5390 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -4.8260 -5.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -3.2560 -6.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 -3.7480 -6.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4960 -2.7380 -6.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 2.0250 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 2.2380 -0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 2.0120 1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -0.0520 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -0.2810 0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1150 1.0520 1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 -0.4750 1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -1.5590 2.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -0.0090 2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 -0.1740 3.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -5.6770 -5.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -4.8430 -5.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -4.9970 -3.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 -2.3200 -7.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -3.2050 -7.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 -4.0670 -7.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1300 -4.9760 -6.6830 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2430 -1.8680 -0.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -2.2970 0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 -2.2330 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 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 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 M CHG 1 41 -1 M END