PUBCHEM-ZINC05441003 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 0 0 0 0 0 0999 V2000 1.2720 -0.1180 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -1.4710 0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -2.6290 1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -3.9360 0.2830 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -2.8760 -1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 -1.6290 -0.7770 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -3.4830 -2.2570 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 -2.7870 -3.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -1.5920 -3.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -3.7110 -4.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -2.9830 -5.9110 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -2.4700 -6.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 -3.4690 -7.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -2.8690 -8.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7550 -3.4620 -9.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3050 -4.5160 -10.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 -4.7010 -11.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 -5.1610 -11.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4670 -4.1440 -10.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 -2.7500 -6.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 -2.3210 -7.6470 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5830 -3.0450 -5.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 -2.3880 -4.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0830 -2.6970 -3.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9230 -3.6390 -4.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6590 -4.2740 -5.6520 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4970 -3.9500 -6.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 -2.8490 2.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -0.1330 1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 0.6090 0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 0.2250 1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -4.4720 -2.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -4.3590 -4.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -4.3570 -4.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -1.5340 -7.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -2.2290 -5.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 -4.3900 -7.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -3.7480 -8.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 -1.9830 -8.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 -2.5980 -7.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3910 -3.3630 -8.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6370 -2.4930 -10.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2740 -4.1890 -11.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4580 -5.4760 -10.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 -5.3040 -12.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2430 -6.1360 -10.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 -3.1820 -11.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -4.5310 -10.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2310 -1.6280 -4.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3570 -2.2060 -2.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8640 -3.9100 -4.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 -4.4580 -7.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -3.1920 3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 -3.6000 3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -1.9280 3.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -3.8820 -9.3530 N 0 3 0 0 0 0 0 0 0 0 0 0 3.4690 -4.7680 -8.8390 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 6 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 32 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 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 56 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 56 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 19 56 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END