PUBCHEM-ZINC02164956 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 0.0860 1.0830 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 1.6530 -1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 2.5160 -4.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 1.9100 -0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8100 1.2660 -1.6400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5260 2.9640 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 3.7830 0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 4.7630 1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 4.9350 1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3580 4.1260 0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 3.1460 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9620 5.9880 2.5650 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.1750 6.7020 3.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 6.1420 2.7200 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0230 1.9180 -2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 2.4280 -3.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 1.6670 -2.2930 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 0.8010 -3.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2060 0.4790 -3.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 -0.3770 -4.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 -0.9140 -5.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -0.5950 -5.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 0.2550 -4.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -0.0030 0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 1.3570 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 1.4830 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 3.6500 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 5.3980 2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4200 4.2640 1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5990 2.5180 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 2.0900 -1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 0.8990 -2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7360 -0.6270 -4.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2000 -1.5830 -5.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -1.0160 -5.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 0.4990 -4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 4 1 0 0 0 0 2 15 2 0 0 0 0 3 16 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 31 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 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 22 2 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M END