PUBCHEM-ZINC00021106 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 0.6880 1.5110 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 0.0850 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -0.5150 1.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -1.7880 1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 -2.5780 0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 -3.8860 0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -4.3700 2.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -2.3470 2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -1.6570 3.5580 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 -0.2030 3.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 -2.4790 4.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8510 -1.7830 5.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6600 -2.7300 6.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -3.8850 4.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 -2.9480 3.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7640 -4.0710 6.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1470 -4.2740 6.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0880 -3.2330 6.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3610 -3.4130 5.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7080 -4.6310 5.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7810 -5.6710 5.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5080 -5.4970 5.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7830 1.5230 -0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 2.0210 -1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 2.0750 0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 0.1050 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -0.4600 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 -2.2060 -0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -4.5070 0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 -5.3880 2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 0.2010 4.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 0.1780 2.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 0.2270 3.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 -3.3620 4.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 -0.8960 5.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 -1.4480 6.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 -2.2110 7.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0840 -3.6150 6.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 -4.8030 4.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4420 -4.1390 4.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4140 -3.4700 2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2900 -2.0820 3.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2410 -5.0220 6.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8460 -3.5720 7.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8440 -2.2740 6.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0850 -2.6030 5.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7000 -4.7700 4.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0500 -6.6200 4.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8030 -6.3240 5.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -3.6430 2.9350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 -3.2040 5.8640 N 0 3 0 0 0 0 0 0 0 0 0 0 5.4390 -2.3750 5.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 30 1 0 0 0 0 7 50 1 0 0 0 0 8 9 1 0 0 0 0 8 50 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 51 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 51 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END