PUBCHEM-ZINC05814658 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -4.7540 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 -5.6180 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7090 -6.7640 -1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8390 -7.5560 -1.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8770 -7.2030 -0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7840 -6.0580 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6520 -5.2680 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5490 -4.0220 0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6920 -3.0700 0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 -4.3990 2.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -5.5350 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6750 -3.7040 -1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -4.9640 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8980 -7.0390 -2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9110 -8.4500 -2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7600 -7.8220 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5950 -5.7820 0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 -3.5320 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6470 -3.5600 0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6180 -2.1690 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6270 -2.8020 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5950 -4.8890 2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8260 -5.0770 2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5660 -3.4980 2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 M END