PUBCHEM-ZINC04566339 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.5670 2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -2.0540 3.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -0.5240 3.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.0180 2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -0.5470 2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -2.0770 2.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 -0.5470 -2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -1.0430 -3.5830 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9240 -2.0340 -3.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 -1.1140 -4.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -2.3060 -5.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 -2.3710 -6.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1750 -1.2440 -6.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 -0.0520 -6.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 0.0140 -5.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 -1.3140 -8.0430 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.6580 -2.3640 -8.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 -0.3210 -8.7150 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5800 -0.1400 -3.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -2.4060 0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 -2.3900 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -3.6570 2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -2.4290 4.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -2.4040 3.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -0.1730 4.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -0.1470 3.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 1.0720 2.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 -0.1960 3.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -0.1860 1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -2.4420 1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 -2.4520 3.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 0.4440 -2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 -1.2360 -2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 -3.1870 -4.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 -3.3030 -6.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 0.8290 -7.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 0.9470 -5.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 0.7630 -4.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -0.4780 -1.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 0.1040 -1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 48 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END