PUBCHEM-ZINC04557176 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 -0.1180 1.4610 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -0.0290 -0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 -0.5640 -0.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -0.7410 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 -2.2120 -0.0240 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2540 -2.5620 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -2.7580 -1.4680 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0810 -3.8520 -1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -2.3460 -2.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 -2.7500 -1.4130 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5820 -2.2640 -0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 -2.7250 0.6710 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4140 -3.8220 0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5390 -2.2620 2.1460 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4060 -1.1750 2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9310 -2.5830 2.7270 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1840 -3.6390 2.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0320 -2.2660 4.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4000 -2.3890 4.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8940 -2.0540 3.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9540 -1.8020 2.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7530 -1.8160 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -2.8850 2.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 -2.4210 2.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8340 -2.0290 -2.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 -2.4440 -3.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 -4.1840 -1.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7350 -4.8660 -0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8580 -4.3040 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7820 -5.1090 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6040 -6.4900 0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4990 -7.0770 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5820 -6.2560 -0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4230 -6.8920 -1.3150 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.6350 -7.7490 -2.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -6.5740 -0.8720 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0080 -2.3330 -2.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -1.8020 -1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 1.9090 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 1.8600 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 1.7190 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -0.2410 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 -1.2620 -2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 -2.8120 -3.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4240 -2.9420 4.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7300 -1.2330 4.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0620 -3.2390 -0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6500 -4.6490 0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3290 -7.1030 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3590 -8.1540 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4280 -1.1080 -1.5500 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 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 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 37 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 30 48 1 0 0 0 0 31 32 2 0 0 0 0 31 49 1 0 0 0 0 32 33 1 0 0 0 0 32 50 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 37 38 1 0 0 0 0 M CHG 1 34 1 M CHG 1 36 -1 M CHG 1 51 -1 M END