%chk=000125460.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125460

0 1
 O   -1.198700      -1.214500      0.9406000    
 O   -3.521200      0.9809000       1.436500    
 O   -2.568200      -3.314700     -0.2728000    
 O    1.409800       1.707900       2.216200    
 O    4.662800     -0.2194000     -0.4014000    
 N   0.7639000      4.7699999E-02  0.7076000    
 N   -1.053900      0.9635000      -1.220500    
 N    3.022000      0.7386000      0.9040000    
 N   -1.283100       1.986700      -1.893500    
 N   -1.491200       2.921500      -2.513100    
 C   -1.472100       1.011600      0.1858000    
 C   -2.852900      0.3992000      0.3170000    
 C  -0.6262000      9.3199998E-02   1.054200    
 C   -2.589200      -1.083100      0.5873000    
 C   -2.850800      -1.969300     -0.6216000    
 C    1.171700     -0.8485000     -0.2711000    
 C    1.701300      0.8903000       1.340700    
 C    2.436300     -0.9911000     -0.6868000    
 C    3.484200     -0.1377000     -6.6000000E-02
 C    2.855600      -1.962700      -1.742800    
 H   -1.411100       2.039700      0.5655000    
 H   -3.498200      0.5575000     -0.5534000    
 H  -0.7273000      0.3908000       2.105800    
 H   -3.168100      -1.445900       1.444800    
 H   -2.195300      -1.707500      -1.457700    
 H   -3.891000      -1.902100     -0.9546000    
 H   -3.644200       1.926000       1.242800    
 H   0.4000000      -1.458000     -0.7298000    
 H    3.715900       1.335100       1.346100    
 H   -3.172400      -3.565900      0.4466000    
 H    3.312900      -1.436300      -2.586900    
 H    2.007900      -2.538000      -2.129800    
 H    3.583900      -2.674200      -1.340300    


%chk=000125460-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000125460

0 1
O -1.330408 -1.117771 1.282717
O -3.725861 0.661175 1.816252
O -1.753939 -3.005489 -0.780415
O 1.131958 2.188014 1.512397
O 4.456648 -0.094227 -0.874230
N 0.625313 0.089498 0.595565
N -1.433961 1.216813 -1.056597
N 2.780143 0.994729 0.331275
N -0.546093 2.028745 -1.462076
N 0.222627 2.722751 -2.037684
C -1.724830 1.120271 0.404315
C -3.077296 0.359745 0.540453
C -0.725932 0.201207 1.205180
C -2.653081 -1.120235 0.601670
C -2.563408 -1.785218 -0.792077
C 1.005902 -1.022605 -0.168084
C 1.501464 1.163714 0.862902
C 2.266617 -1.153200 -0.703386
C 3.262703 -0.098921 -0.457693
C 2.685022 -2.345955 -1.527254
H -1.752348 2.122060 0.870755
H -3.733157 0.584095 -0.323267
H -0.594473 0.609898 2.221398
H -3.324922 -1.683779 1.273136
H -2.060770 -1.122280 -1.513868
H -3.595177 -1.987077 -1.152915
H -4.052233 1.596531 1.815101
H 0.233161 -1.789256 -0.286998
H 3.441744 1.758722 0.503287
H -2.071542 -3.616850 -0.068383
H 3.020131 -2.029237 -2.531673
H 1.854658 -3.063091 -1.639136
H 3.544441 -2.861476 -1.061267


