PUBCHEM-ZINC06200691 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 54 0 0 1 0 0 0 0 0999 V2000 -0.5350 1.4020 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 0.1000 -0.3350 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7820 0.2440 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -0.4680 0.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -1.3630 1.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 0.0710 1.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9930 -0.4310 2.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4210 0.7090 3.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 1.7910 2.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3460 2.2750 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8960 1.1080 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5610 2.9630 3.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0530 3.1350 4.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5140 3.7880 2.7380 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0790 4.9830 3.3860 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3700 4.7030 4.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0690 6.1220 3.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3310 5.4950 2.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4980 4.9180 1.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -0.9040 -0.6940 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -0.9390 -1.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -0.1460 -2.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 -1.9850 -1.9030 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1800 -2.2700 -3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 -2.6150 -4.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 -3.5110 -2.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1480 -1.1170 -3.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 2.1630 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 1.8120 -0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 1.2410 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 -1.1680 2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8720 -0.9460 1.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 1.1460 3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0450 0.3150 3.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1220 1.3520 1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 2.8130 1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 2.9890 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7670 0.6340 -0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 1.4890 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 3.6170 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4840 7.0100 3.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7640 6.4110 2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1650 5.8340 3.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -1.6200 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5780 -3.3800 -4.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9370 -2.9850 -5.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 -1.7470 -4.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5950 -3.3130 -1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6670 -3.8290 -3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 -4.3480 -2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6250 -0.2220 -3.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8780 -1.3920 -4.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6890 -0.8280 -2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0170 6.3890 3.1780 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 20 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 12 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 10 37 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 54 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 M CHG 1 54 -1 M END