%chk=000125323.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125323

-1 1
 O   -2.615600     -0.5912000      0.1311000    
 O    2.751100      8.8699996E-02  0.4686000    
 N    1.338000      4.3099999E-02  0.1374000    
 C   0.5865000       1.345500     -5.3399999E-02
 C   0.6576000      -1.304600     -3.7000000E-03
 C  -0.8983000       1.087400      0.2253000    
 C  -0.5425000      -1.148900     -0.9519000    
 C   -1.520500     -3.4800000E-02 -0.5960000    
 C    1.090700       2.380900      0.9679000    
 C   0.8579000       1.835000      -1.478300    
 C    1.636700      -2.307900     -0.6420000    
 C   0.2689000      -1.779100       1.399000    
 C   -3.610500      0.3860000      0.3959000    
 H   -1.461100       2.013800      4.4300001E-02
 H   -1.029100      0.8854000       1.296600    
 H   -1.079100      -2.104600      -1.022800    
 H  -0.1602000     -0.9503000      -1.961900    
 H   -1.914300      0.3673000      -1.539000    
 H    1.031100       1.996600       1.993000    
 H    2.128900       2.677700      0.7820000    
 H   0.4883000       3.295700      0.9206000    
 H   0.5616000       1.109300      -2.239800    
 H   0.3118000       2.763600      -1.678600    
 H    1.923200       2.040600      -1.634200    
 H    1.133500      -3.259700     -0.8497000    
 H    2.037900      -1.930900      -1.590100    
 H    2.484800      -2.536900      1.3000000E-02
 H    1.152700      -1.915900       2.032900    
 H  -0.3866000      -1.078600       1.921100    
 H  -0.2521000      -2.742000       1.350300    
 H   -3.868500      0.9542000     -0.5036000    
 H   -3.309900       1.058500       1.204000    
 H   -4.510400     -0.1387000      0.7308000    


%chk=000125323-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000125323

-1 1
O -3.026004 -0.410262 -0.189430
O 2.548661 0.199994 -0.564889
N 1.098699 0.052416 -0.592663
C 0.457879 1.289866 0.085010
C 0.708463 -1.294511 0.023609
C -1.021541 0.974432 0.455430
C -0.848633 -1.471191 -0.077125
C -1.566196 -0.159887 -0.428060
C 1.292332 1.786792 1.299759
C 0.525665 2.366806 -1.032250
C 1.412220 -2.347212 -0.870253
C 1.247186 -1.470945 1.477929
C -3.875277 0.600122 -0.799578
H -1.635989 1.892864 0.350691
H -1.099106 0.646300 1.511220
H -1.258829 -1.822250 0.891375
H -1.106294 -2.236264 -0.834551
H -1.430429 0.089856 -1.501191
H 0.964663 1.337300 2.256119
H 2.322982 1.432772 1.039581
H 1.277247 2.889683 1.403325
H -0.100608 2.070436 -1.895956
H 0.200065 3.363332 -0.668272
H 1.578087 2.405341 -1.370276
H 1.182495 -3.378001 -0.530555
H 1.083135 -2.223159 -1.919642
H 2.496777 -2.142187 -0.830835
H 2.268436 -1.034702 1.460007
H 0.626605 -0.933067 2.218821
H 1.301447 -2.537135 1.779748
H -3.678040 0.695418 -1.892049
H -3.745701 1.604342 -0.339789
H -4.917899 0.267901 -0.646458


