PUBCHEM-ZINC05909684 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 0 0 0 0 0 0999 V2000 -0.7230 -2.5290 -0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -3.8480 -0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -3.8020 0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -4.1960 1.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -3.9990 3.2740 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 -3.3750 2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 -3.3270 0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9330 -2.8440 -0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 -1.6660 -0.5130 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 -3.7050 -0.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4320 -3.1560 -2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2180 -4.2740 -2.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -2.9780 2.5940 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2810 -3.0720 3.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 -3.5070 4.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6240 -2.6520 4.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 -2.6160 5.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9130 -2.7630 6.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1330 -3.5830 7.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1520 -3.7150 8.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 -3.0400 8.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7260 -2.2270 7.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -2.0790 6.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -1.5100 7.3260 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5790 -1.6350 8.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -0.7940 6.3600 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1100 -4.7400 2.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -1.7060 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -2.5620 -1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -2.3770 0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -4.6700 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 -4.0000 -1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 -2.7060 -2.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1240 -2.3960 -1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9090 -4.7240 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5270 -5.0340 -3.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 -3.8620 -3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5220 -2.6320 1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3480 -2.3700 3.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9870 -2.4800 5.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -4.1110 7.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 -4.3480 9.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 -3.1480 9.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 -1.4410 5.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 -5.8220 2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -4.4960 3.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 -4.2950 1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 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 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 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 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END