PUBCHEM-ZINC05817452 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 1.2910 -3.1310 -4.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -2.8910 -3.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -3.4830 -3.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 -3.3950 -2.2090 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0020 -3.2680 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -4.9040 -2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 -5.0950 -2.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 -2.5870 -2.0920 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5830 -3.1210 -2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 -1.3060 -1.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 -0.7190 -1.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1190 -0.7150 -1.6170 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2330 0.6850 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4820 1.6890 -2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6800 3.1230 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 3.2720 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0600 2.2860 0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8670 0.8440 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3880 -1.3660 -2.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4420 -1.6880 -3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7790 -2.3140 -3.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1180 -3.5170 -3.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1360 -3.1440 -1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8090 -2.5340 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 -2.6750 -4.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -4.1990 -4.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -2.6860 -5.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -1.8050 -3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -4.5500 -3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -3.3470 -2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -2.9820 -4.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2910 0.9690 -1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8380 1.6040 -3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 1.4760 -2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7280 3.4150 -1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0760 3.8060 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5080 4.2970 0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 3.1110 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1290 2.5340 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 2.3850 1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8280 0.5550 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4880 0.1760 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1820 -0.6200 -1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6440 -2.3670 -3.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2900 -0.7670 -4.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7480 -2.6200 -4.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5740 -1.5630 -3.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3830 -4.3130 -3.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0960 -3.9170 -3.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3540 -4.0330 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9470 -2.4280 -1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9060 -2.1770 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0590 -3.3280 -1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -5.7370 -2.0970 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 54 1 0 0 0 0 8 9 1 0 0 0 0 8 10 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 19 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 M CHG 1 54 -1 M END