%chk=000128143.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128143

0 1
 O   0.5113000       1.449000      0.4690000    
 O    2.712600       1.641900     -0.3145000    
 N    2.880500      -1.252200     -0.5835000    
 N   -2.366300      0.2551000      -1.941300    
 C    1.767100      0.7597000      0.3299000    
 C    1.604100     -0.5050000     -0.5547000    
 C    2.279800      0.4132000       1.731400    
 C    3.541200     -0.4394000       1.657500    
 C    3.351400      -1.652000      0.7468000    
 C   0.3810000      -1.346000     -0.1464000    
 C   0.6239000       2.593600     -0.3735000    
 C    2.087500       2.923800     -0.3063000    
 C  -0.8917000     -0.7233000     -0.6365000    
 C    2.866500      -2.388000      -1.500500    
 C   -2.074800     -0.5631000      0.1137000    
 C   -1.083300     -0.2199000      -1.888600    
 C   -2.995400      5.8699999E-02 -0.7325000    
 C   -2.468800     -0.8799000       1.428800    
 C   -4.295800      0.3807000     -0.3276000    
 C   -3.766400     -0.5638000       1.847600    
 C   -4.664100      5.6899998E-02  0.9812000    
 H    1.476200     -0.1435000      -1.582600    
 H    1.505500     -0.1079000       2.306900    
 H    2.501800       1.331400       2.289400    
 H    4.374700      0.1700000       1.285600    
 H    3.820000     -0.7729000       2.663600    
 H    4.318900      -2.162200      0.6613000    
 H    2.656700      -2.361700       1.213400    
 H   0.3516000      -1.504700      0.9363000    
 H   0.4128000      -2.344600     -0.5957000    
 H  -2.0099999E-02   3.400900     -1.6700000E-02
 H   0.3236000       2.313700      -1.388200    
 H    2.435500       3.529800      -1.146100    
 H    2.346400       3.423300      0.6335000    
 H    3.889900      -2.742800      -1.668000    
 H    2.476200      -2.097700      -2.482200    
 H    2.283100      -3.236000      -1.127600    
 H  -0.4482000     -0.1561000      -2.760900    
 H   -2.791700      0.6854000      -2.750800    
 H   -1.783200      -1.363400       2.118600    
 H   -4.995300      0.8640000      -1.001400    
 H   -4.075900     -0.8058000       2.860900    
 H   -5.666900      0.2936000       1.327500    


%chk=000128143-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000128143

0 1
O 0.820701 1.297059 1.632468
O 2.613419 1.853567 0.180958
N 2.610965 -0.909560 -0.869665
N -2.585078 -1.770639 -1.917998
C 1.950668 0.710022 0.871767
C 1.436803 -0.274778 -0.218351
C 2.909656 0.053979 1.870513
C 4.071833 -0.627309 1.116206
C 3.531638 -1.605000 0.054674
C 0.371444 -1.299158 0.362798
C 0.560682 2.633723 1.049622
C 1.974927 3.095995 0.667850
C -0.940787 -1.310078 -0.385361
C 2.295207 -1.678364 -2.081412
C -2.110674 -0.496225 -0.084280
C -1.273432 -2.069499 -1.509067
C -3.124902 -0.806888 -1.059831
C -2.402817 0.452949 0.932671
C -4.399337 -0.196795 -1.048672
C -3.673080 1.061046 0.951090
C -4.660018 0.742293 -0.029699
H 0.934592 0.340282 -0.988044
H 2.345404 -0.690081 2.466204
H 3.277292 0.826703 2.568549
H 4.674470 0.148196 0.609850
H 4.724747 -1.167679 1.827253
H 4.370011 -2.008792 -0.543935
H 3.049092 -2.482692 0.563020
H 0.171517 -1.053771 1.421113
H 0.822236 -2.310321 0.350403
H 0.081169 3.240161 1.833966
H -0.104401 2.552145 0.168404
H 2.005409 3.823861 -0.159183
H 2.519370 3.495163 1.546964
H 3.228968 -1.902327 -2.630243
H 1.640138 -1.079583 -2.739415
H 1.780321 -2.654078 -1.884809
H -0.678268 -2.807335 -2.044846
H -3.066417 -2.195397 -2.706936
H -1.645210 0.699270 1.684494
H -5.162481 -0.441788 -1.796366
H -3.915004 1.790977 1.732088
H -5.638874 1.233548 0.011990


