%chk=000126227.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126227

0 1
 O   -2.933900      -1.841000      0.1247000    
 O   -5.085000     -0.1723000     -0.7398000    
 O    2.991800       2.406100      3.3399999E-02
 N  -0.3336000     -0.9335000     -5.2499998E-02
 N   0.3088000       1.725300     -0.1028000    
 N    2.042800      -1.455800     -1.0000000E-03
 N    3.703800      0.2222000      4.9899999E-02
 N    4.260100      -2.063300      6.7800000E-02
 C   -1.424600      9.8999999E-03  0.1861000    
 C   -2.718100     -0.5354000     -0.4036000    
 C   -1.071000       1.385600     -0.4140000    
 C   -3.922700      0.3684000     -0.1148000    
 C    1.002500     -0.5574000     -3.3199999E-02
 C    1.293000      0.7632000     -3.6899999E-02
 C   -4.193500      0.5091000       1.378600    
 C    2.728300       1.206200      1.9400001E-02
 C    3.351400      -1.037300      3.8800001E-02
 H   -1.502200      9.7000003E-02   1.276400    
 H   -2.615600     -0.6640000      -1.488800    
 H   -1.185900       1.373400      -1.504700    
 H   -1.725500       2.167700     -1.6899999E-02
 H  -0.5193000      -1.929100      1.1900000E-02
 H   -3.771300       1.359300     -0.5545000    
 H   0.6000000       2.696300     -0.1394000    
 H   -4.352200     -0.4657000       1.852000    
 H   -5.114800       1.080000       1.541700    
 H   -3.387600       1.030800       1.901000    
 H    1.800200      -2.440200     -6.0000003E-04
 H   -3.773800      -2.168000     -0.2407000    
 H   -5.823000      0.4373000     -0.5687000    
 H    5.257200      -1.880600      9.8499998E-02
 H    3.963800      -3.033000      5.8400001E-02


%chk=000126227-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126227

0 1
O -2.888295 -1.831424 0.128406
O -5.049413 -0.481442 -0.716308
O 3.073030 2.425200 0.109466
N -0.359540 -0.941794 -0.080503
N 0.344825 1.778150 0.124407
N 1.988863 -1.524034 -0.083954
N 3.716081 0.144744 0.095421
N 4.279788 -2.134048 -0.069927
C -1.409792 0.059527 0.196306
C -2.713464 -0.473774 -0.418509
C -0.978770 1.436383 -0.392068
C -3.978422 0.366057 -0.126987
C 0.975718 -0.549535 -0.024973
C 1.341236 0.786808 0.060195
C -4.246901 0.639994 1.360769
C 2.750972 1.187552 0.081291
C 3.328141 -1.118370 -0.004199
H -1.543102 0.177898 1.291376
H -2.596787 -0.538402 -1.521694
H -1.006627 1.364284 -1.505020
H -1.702406 2.211737 -0.081145
H -0.653551 -1.913015 0.046322
H -3.919750 1.320223 -0.690992
H 0.707173 2.734066 0.065546
H -4.217740 -0.300045 1.938120
H -5.238377 1.112297 1.498580
H -3.496767 1.332891 1.783020
H 1.752829 -2.481250 -0.351022
H -3.793057 -2.127077 -0.158972
H -5.936030 -0.099479 -0.501340
H 5.246632 -1.815765 -0.047107
H 4.073600 -3.087159 0.221195


