%chk=000112121.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000112121

0 1
 O    2.710800      -2.134000       1.157000    
 O    1.927000     -0.3787000       2.370600    
 O   -2.238100       3.295300      0.1229000    
 O  -7.0900001E-02   2.945500      0.1401000    
 O   -4.571600      -2.423700     -0.3734000    
 O   -5.315600     -0.3633000     -0.2290000    
 N   0.9277000      0.6727000     -1.7800000E-02
 N   -1.250300       2.525200      8.2199998E-02
 N   -4.371600      -1.188900     -0.2737000    
 C    3.340200      0.5804000     -0.4001000    
 C    4.625900     -0.2645000     -0.5166000    
 C    2.071700     -0.2130000     -6.2399998E-02
 C    4.505800      -1.367200      -1.569300    
 C    5.811800      0.6437000     -0.8543000    
 C  -0.3831000      0.2338000     -7.9499997E-02
 C    2.210100     -0.8783000       1.291200    
 C   -1.475400       1.124700     -3.3399999E-02
 C  -0.6591000      -1.143700     -0.1922000    
 C   -2.787800      0.6569000     -9.7300000E-02
 C   -1.971600      -1.611500     -0.2561000    
 C   -3.036000     -0.7112000     -0.2087000    
 H    3.499300       1.351500      0.3669000    
 H    3.177800       1.122000      -1.342200    
 H    4.843000     -0.7315000      0.4512000    
 H    1.920000     -0.9635000     -0.8443000    
 H    1.110700       1.648600      0.1741000    
 H    5.462400      -1.886200      -1.695300    
 H    3.768900      -2.124500      -1.289400    
 H    4.218100     -0.9549000      -2.542300    
 H    5.673000       1.136300      -1.822800    
 H    5.935700       1.420900     -9.2799999E-02
 H    6.742900      6.8599999E-02 -0.8972000    
 H   0.1228000      -1.895600     -0.2311000    
 H   -3.620900       1.355000     -6.0400002E-02
 H   -2.127800      -2.683900     -0.3418000    
 H    2.813100      -2.581200       2.024100    


%chk=000112121-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000112121

0 1
O 2.381020 -2.384155 1.074988
O 2.377255 -0.444554 2.363864
O -2.294615 3.356059 -0.047032
O -0.043302 3.031941 -0.005290
O -4.697519 -2.427766 -0.206455
O -5.426517 -0.261638 -0.168015
N 0.929886 0.599904 -0.069227
N -1.272996 2.573679 -0.040102
N -4.488503 -1.150271 -0.173496
C 3.357458 0.563769 -0.425389
C 4.687959 -0.228483 -0.515059
C 2.099463 -0.287365 -0.105658
C 4.656810 -1.314143 -1.617751
C 5.852107 0.762259 -0.754422
C -0.374827 0.185650 -0.082555
C 2.290957 -0.995337 1.251033
C -1.481751 1.123301 -0.074796
C -0.715405 -1.212690 -0.114032
C -2.821363 0.684442 -0.103477
C -2.038548 -1.644145 -0.146381
C -3.090755 -0.688506 -0.141619
H 3.450737 1.343146 0.356953
H 3.175948 1.076563 -1.390971
H 4.865205 -0.727945 0.460788
H 1.962087 -1.063943 -0.878204
H 1.062886 1.623674 -0.001270
H 5.643781 -1.803832 -1.703803
H 3.915833 -2.106243 -1.406546
H 4.418410 -0.866661 -2.602125
H 5.731429 1.283150 -1.723666
H 5.901875 1.529107 0.040478
H 6.821146 0.231911 -0.776489
H 0.084620 -1.957052 -0.101577
H -3.633894 1.415494 -0.097004
H -2.289896 -2.707783 -0.170477
H 2.541918 -2.829739 1.951682


