%chk=000045233.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045233

0 1
 O   0.4439000      0.2332000     -1.4000000E-03
 O    1.255400     -0.1551000       2.117600    
 N   -2.912300       1.853800      0.1397000    
 C   -1.780600     -0.1227000     -0.8878000    
 C   -3.084900     -0.9357000     -0.7566000    
 C  -0.7918000     -0.4314000      0.2564000    
 C   -2.802800      -2.433500     -0.5752000    
 C   -3.967300     -0.3738000      0.3699000    
 C   -2.105700       1.382500     -0.9952000    
 C  -0.5237000      -1.931900      0.3746000    
 C   -1.809100      -2.729800      0.5443000    
 C   -4.189500       1.131600      0.2089000    
 C   -3.145100       3.294500      3.9600000E-02
 C    1.421700      4.7499999E-02  0.9248000    
 C    2.762100      0.1244000      0.2910000    
 C    3.827900      0.5820000       1.038600    
 C    2.900700     -0.2645000      -1.025700    
 C    5.087300      0.6542000      0.4434000    
 C    4.160200     -0.1923000      -1.620700    
 C    5.253500      0.2671000     -0.8861000    
 H   -1.291100     -0.4044000      -1.831400    
 H   -3.648500     -0.8225000      -1.693700    
 H   -1.194100     -5.4800000E-02   1.205400    
 H   -2.396300      -2.828500      -1.515400    
 H   -3.737700      -2.975200     -0.3898000    
 H   -3.520300     -0.5662000       1.352200    
 H   -4.939000     -0.8826000      0.3652000    
 H   -1.168000       1.949500      -1.045500    
 H   -2.634200       1.567600      -1.940600    
 H   0.1336000      -2.164700       1.218800    
 H   1.1800000E-02  -2.280800     -0.5186000    
 H   -2.259100      -2.502500       1.517500    
 H   -1.577000      -3.801200      0.5500000    
 H   -4.795000       1.319900     -0.6875000    
 H   -4.768900       1.484000       1.071000    
 H   -3.699100       3.563100     -0.8671000    
 H   -2.193900       3.838300      3.6800001E-02
 H   -3.708500       3.654300      0.9076000    
 H    3.710400      0.8894000       2.073600    
 H    2.069200     -0.6384000      -1.615400    
 H    5.938500       1.012400       1.015000    
 H    4.290700     -0.4967000      -2.655100    
 H    6.234200      0.3226000      -1.349300    


%chk=000045233-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000045233

0 1
O 0.482947 -0.460711 -0.236193
O 1.191301 -0.319555 1.986302
N -2.538342 1.731962 -0.005767
C -1.843327 -0.490503 -0.920415
C -3.282781 -1.037545 -0.666512
C -0.888954 -0.891780 0.219623
C -3.262725 -2.562636 -0.384127
C -3.996401 -0.226865 0.446904
C -1.882442 1.039359 -1.137974
C -0.868302 -2.408496 0.478324
C -2.294711 -2.938105 0.763259
C -3.940944 1.285877 0.158079
C -2.416707 3.198377 -0.098920
C 1.427330 -0.201512 0.756470
C 2.736844 0.232266 0.179482
C 3.786712 0.558703 1.076783
C 2.949354 0.324825 -1.220843
C 5.037909 0.976225 0.578276
C 4.203488 0.741880 -1.715564
C 5.248712 1.068912 -0.818728
H -1.454765 -0.956594 -1.850656
H -3.854856 -0.866281 -1.604476
H -1.113186 -0.331271 1.144623
H -2.942864 -3.093732 -1.304642
H -4.287817 -2.913415 -0.151383
H -3.530683 -0.413041 1.432155
H -5.053562 -0.551208 0.516732
H -0.852220 1.425680 -1.239169
H -2.416606 1.247879 -2.104436
H -0.193193 -2.629127 1.324425
H -0.459383 -2.913349 -0.420134
H -2.661321 -2.526070 1.723889
H -2.261414 -4.037106 0.887700
H -4.547525 1.509697 -0.762080
H -4.393839 1.850976 0.994420
H -2.929092 3.628982 -0.997383
H -1.350131 3.481683 -0.146113
H -2.855387 3.666952 0.800420
H 3.597877 0.478608 2.152511
H 2.132725 0.067954 -1.901298
H 5.846454 1.229324 1.272628
H 4.368114 0.812150 -2.796452
H 6.221313 1.393330 -1.205943


