PUBCHEM-ZINC05113180 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 35 0 0 1 0 0 0 0 0999 V2000 -0.1220 1.3250 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -0.1910 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -0.9060 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 2.0330 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 3.5620 -0.0470 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5330 3.8020 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 4.1160 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4810 3.6360 -0.5970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 5.6010 -1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 5.9880 -2.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8470 5.2330 -2.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 7.2320 -2.6040 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 7.7960 -3.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 9.2130 -3.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 9.6720 -3.5530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 1.6010 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 1.6400 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 -0.5050 -0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -0.4750 0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8690 -0.6460 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -0.7170 -0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 1.6550 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 1.7540 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 6.1280 -1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 5.9040 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 7.8490 -2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 7.1220 -4.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7540 7.8200 -2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -2.3670 -0.0090 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9170 -2.8890 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -2.6300 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -2.6930 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 4.9540 1.0930 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4880 4.1430 -1.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 3.7320 -1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 9.7380 -4.7500 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 34 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 34 35 1 0 0 0 0 M CHG 1 29 1 M CHG 1 33 -1 M CHG 1 36 -1 M END