%chk=000132224.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132224

0 1
 O    4.384900      -2.084200     -0.6088000    
 O   -3.124900     -5.8300000E-02  -2.459700    
 O   -5.028900      -1.143500     -0.7498000    
 N   0.5023000       2.644000     -0.2247000    
 C  -0.1215000      0.7976000       1.321300    
 C    1.092300      4.1200001E-02  0.8055000    
 C   1.1100000E-02   2.322500       1.115500    
 C    2.014700      0.6720000     -4.9800001E-02
 C    1.861000       2.128100     -0.4137000    
 C   -1.439800      0.2760000      0.7609000    
 C    3.125400     -4.4399999E-02 -0.5174000    
 C    1.292200      -1.300800       1.165800    
 C    3.310500      -1.378400     -0.1554000    
 C    2.394900      -2.005900      0.6851000    
 C   -1.684900      0.3469000     -0.6069000    
 C   -2.389200     -0.2665000       1.621400    
 C    4.134000      0.6003000      -1.417400    
 C   -2.891500     -0.1295000      -1.119300    
 C   -3.595700     -0.7429000       1.109000    
 C   -3.846900     -0.6744000     -0.2615000    
 H  -0.1333000      0.6487000       2.411300    
 H  -0.9538000       2.817900       1.278000    
 H   0.7026000       2.739600       1.860200    
 H    2.564900       2.720000      0.1844000    
 H    2.103100       2.280000      -1.470700    
 H   0.5087000       3.655600     -0.3520000    
 H   0.5885000      -1.803800       1.824400    
 H    2.527900      -3.044100      0.9774000    
 H  -0.9508000      0.7476000      -1.298500    
 H   -2.207400     -0.3265000       2.690800    
 H    3.714500      0.7286000      -2.420700    
 H    4.439500       1.576500      -1.026000    
 H    5.055500      1.7999999E-02  -1.516400    
 H   -4.331200      -1.165200       1.788500    
 H    4.345100      -2.988300     -0.2525000    
 H   -4.005400     -0.4323000      -2.637100    
 H   -5.564100      -1.482900     -1.1900000E-02


%chk=000132224-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000132224

0 1
O 4.533650 -2.017923 -0.668752
O -3.105923 -0.292516 -2.487833
O -5.132093 -1.023792 -0.865232
N 0.477185 2.581228 -0.146295
C -0.112777 0.738740 1.384688
C 1.113311 0.020995 0.803033
C 0.045571 2.277756 1.225767
C 2.047873 0.674993 -0.046439
C 1.846492 2.136420 -0.438020
C -1.440790 0.237458 0.807747
C 3.200729 -0.007655 -0.532768
C 1.332929 -1.335892 1.142025
C 3.384686 -1.363683 -0.166030
C 2.456506 -2.033888 0.665064
C -1.654332 0.178487 -0.593937
C -2.491377 -0.139042 1.681803
C 4.213361 0.679941 -1.430286
C -2.894773 -0.240861 -1.103524
C -3.742805 -0.566716 1.175096
C -3.938547 -0.615312 -0.215393
H -0.137704 0.530747 2.474356
H -0.920057 2.775316 1.422515
H 0.779464 2.637792 1.991621
H 2.625968 2.746489 0.093531
H 2.038208 2.261526 -1.520522
H 0.282205 3.540690 -0.447795
H 0.608444 -1.849521 1.784913
H 2.612848 -3.086291 0.936997
H -0.862169 0.472985 -1.286139
H -2.335676 -0.100688 2.766425
H 3.786262 0.893482 -2.429995
H 4.541847 1.646817 -1.004492
H 5.098997 0.043414 -1.573810
H -4.548750 -0.859625 1.860307
H 4.556471 -2.955989 -0.356969
H -4.031706 -0.612215 -2.654581
H -5.829228 -1.284468 -0.217775


