%chk=000163159.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163159

0 1
 O   -1.592600      -1.037100       1.189000    
 O   -1.829800      -3.222400     -0.2208000    
 O   -3.749000      0.7880000      0.5181000    
 N    3.298700      0.7132000      0.4612000    
 C   0.7585000     -0.6767000      0.6654000    
 C    1.807100      -1.021500     -0.4031000    
 C    2.549900      0.3087000     -0.7532000    
 C  -0.3170000      -1.740400      0.9876000    
 C    1.469100     -0.1453000       1.925900    
 C  -0.1533000      0.3674000      0.1106000    
 C    1.589700       1.404500      -1.331600    
 C    2.445400       1.002100       1.618100    
 C   0.1967000       1.382000     -0.7621000    
 C  -0.4599000      -2.853200     -8.3499998E-02
 C    1.186500      -1.724600      -1.583300    
 C   -1.454500      0.1347000      0.4954000    
 C   0.1370000      -2.546000      -1.431100    
 C    4.254800       1.789400      0.2223000    
 C  -0.8133000       2.263000      -1.152000    
 C   -2.466500      0.9951000      0.1305000    
 C   -2.132300       2.079900     -0.6902000    
 C   -4.725000       1.739000      8.6800002E-02
 H    2.543200      -1.726500      1.2400000E-02
 H    3.294500      8.1799999E-02  -1.528700    
 H  -9.8800004E-02  -2.231000       1.945000    
 H    2.030700     -0.9692000       2.386600    
 H   0.7460000      0.1975000       2.677100    
 H    1.497800       1.220900      -2.410800    
 H    2.013700       2.407800      -1.226500    
 H    1.887800       1.935400       1.471100    
 H    3.070500       1.155400       2.506700    
 H   6.6600002E-02  -3.746100      0.2781000    
 H    1.626800      -1.593600      -2.566900    
 H  -0.2529000      -3.070000      -2.299100    
 H    3.773300       2.753900      3.2699998E-02
 H    4.905200       1.552900     -0.6269000    
 H    4.911900       1.910000       1.091100    
 H  -0.5953000       3.080000      -1.834800    
 H   -2.859900       2.806100      -1.039400    
 H   -2.165000      -3.435100      0.6669000    
 H   -4.512500       2.738100      0.4819000    
 H   -5.688200       1.425500      0.5022000    
 H   -4.828000       1.738900      -1.003400    


%chk=000163159-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000163159

0 1
O -1.621110 -1.074021 1.152468
O -1.737890 -3.485876 0.022467
O -3.815580 0.696844 0.485068
N 3.337191 0.692643 0.461868
C 0.766594 -0.661779 0.695038
C 1.797956 -1.012651 -0.420756
C 2.566141 0.305348 -0.756706
C -0.264840 -1.773787 1.060963
C 1.537551 -0.169454 1.953800
C -0.144118 0.414121 0.125359
C 1.634856 1.437440 -1.330340
C 2.476503 1.007466 1.628188
C 0.226065 1.447156 -0.748984
C -0.385027 -2.924193 0.008647
C 1.094960 -1.665220 -1.595634
C -1.472326 0.156740 0.469063
C 0.060797 -2.521308 -1.390165
C 4.372106 1.713909 0.226018
C -0.806549 2.329571 -1.154022
C -2.514357 1.026263 0.080955
C -2.144045 2.142188 -0.721440
C -4.891638 1.591837 0.055965
H 2.562699 -1.701090 -0.003188
H 3.319602 0.071528 -1.535124
H -0.111755 -2.195207 2.067295
H 2.136642 -1.014024 2.347857
H 0.820651 0.136832 2.739261
H 1.549441 1.297887 -2.427468
H 2.137093 2.416252 -1.193888
H 1.873149 1.934853 1.465372
H 3.134858 1.203214 2.495779
H 0.267797 -3.751232 0.356226
H 1.440487 -1.436109 -2.613158
H -0.459045 -3.024677 -2.214064
H 3.972769 2.738094 0.015932
H 5.002207 1.413167 -0.630565
H 5.021765 1.789881 1.117222
H -0.581920 3.159325 -1.834774
H -2.911321 2.847869 -1.055260
H -2.355976 -2.730716 0.227737
H -4.748778 2.614371 0.457439
H -5.810259 1.154453 0.473408
H -4.965744 1.634593 -1.048556


