PUBCHEM-ZINC04214587 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 0.1950 2.1130 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 0.5940 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 0.0270 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 -1.5040 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6270 -2.0910 -0.0120 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2020 -1.6500 0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5790 -3.6080 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9910 -4.1220 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4520 -4.9090 0.8760 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8310 -3.6600 -1.1450 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6430 -2.1240 -1.2880 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1680 -1.6000 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 -1.7500 -1.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2270 -1.6430 -2.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7080 -2.3590 -3.6490 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6310 -2.1530 -3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 -1.8310 -4.9000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4970 -1.9610 -4.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8800 -2.5330 -6.1650 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8740 -2.1640 -6.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9210 -4.0850 -6.0900 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1650 -4.4270 -6.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4370 -4.6280 -4.7120 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3420 -4.6800 -4.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9860 -3.8550 -3.4970 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.0680 -4.0240 -3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3630 -4.3650 -2.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0850 -7.1030 -5.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1880 -4.4820 -6.2720 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.1630 -2.0700 -8.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1930 -0.4230 -5.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3170 -0.0530 -4.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1910 -3.9970 -0.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 2.4970 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 2.4620 -1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 2.5430 0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 0.1970 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 0.2780 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 0.4290 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 0.3560 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 -1.8890 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -1.8230 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -4.0700 -0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 -3.9060 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2010 -7.1660 -4.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 -6.8530 -6.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6460 -8.0400 -5.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 -1.2420 -8.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9610 -1.8810 -9.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6650 -3.0170 -8.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1660 -4.7110 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9630 -6.0440 -4.6430 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.2940 -6.2640 -3.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8100 -5.9300 -5.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7830 -2.1570 -7.3190 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.4480 -2.9700 -7.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3010 -1.3020 -7.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 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 27 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 25 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 31 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 55 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 29 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 52 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 52 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 33 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 M CHG 1 29 -1 M CHG 1 52 1 M CHG 1 55 1 M END