%chk=000131491.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131491

0 1
 O   -2.459900      -3.924400     -0.9116000    
 O   -3.700500      -1.600300      4.6000000E-02
 O    5.522500      -1.270400     -2.7700000E-02
 O    7.123000       3.208300      0.2542000    
 N   0.5617000      -2.080500      0.1933000    
 N    2.847700     -0.3725000      6.7299999E-02
 C    1.870200      -2.556200      0.6592000    
 C   0.7385000      -1.157400     -0.9342000    
 C    2.745700      -1.389200       1.121700    
 C    1.577200      5.6100000E-02 -0.5257000    
 C  -0.2854000      -3.207900     -0.1943000    
 C   -1.695300      -2.759900     -0.5867000    
 C    3.927000      0.5170000      0.1138000    
 C   -2.418000      -1.997300      0.5216000    
 C    5.261700      6.4099997E-02  6.5899998E-02
 C    3.704500       1.905800      0.2105000    
 C    6.327900      0.9621000      0.1127000    
 C    4.770800       2.803600      0.2574000    
 C    6.082600       2.331800      0.2086000    
 C   -4.226600     -0.4542000      0.5793000    
 C   -4.542400      0.6468000     -0.2305000    
 C   -5.083600       1.809700      0.3675000    
 C   -4.438300     -0.4147000       1.956300    
 C    5.629900      -1.818700      -1.339600    
 C   -4.334600      0.6219000      -1.619200    
 C   -5.291800       1.834700       1.756300    
 C   -4.970800      0.7289000       2.544300    
 C   -5.400900       2.913500     -0.4407000    
 C   -4.655400       1.727800      -2.406900    
 C   -5.187400       2.871600      -1.818800    
 H    1.740100      -3.241500       1.505600    
 H    2.388200      -3.110900     -0.1350000    
 H  -0.2150000     -0.7540000      -1.287100    
 H    1.216300      -1.666300      -1.782400    
 H    3.716600      -1.789700       1.427700    
 H    2.304900     -0.9274000       2.015300    
 H    1.016200      0.6659000      0.1943000    
 H    1.754100      0.6645000      -1.421500    
 H   0.1580000      -3.782200      -1.019500    
 H  -0.3722000      -3.913600      0.6431000    
 H   -1.689700      -2.167900      -1.507200    
 H   -2.565800      -2.650300       1.389900    
 H   -1.836800      -1.119300      0.8279000    
 H    2.697600       2.312000      0.2647000    
 H   -3.357200      -3.628900      -1.143200    
 H    7.348500      0.5888000      7.5099997E-02
 H    4.574000       3.869400      0.3350000    
 H   -4.204000      -1.270000       2.584000    
 H    5.823400      -2.890900      -1.247400    
 H    4.697500      -1.679100      -1.895600    
 H    6.462500      -1.357800      -1.880400    
 H   -3.919800     -0.2559000      -2.110100    
 H   -5.707300       2.717800       2.237200    
 H   -5.138900      0.7605000       3.616800    
 H    7.957200       2.710100      0.2095000    
 H   -5.818000       3.817900     -2.4000001E-03
 H   -4.489400       1.695900      -3.479800    
 H   -5.436900       3.732100      -2.432600    


%chk=000131491-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000131491

0 1
O -2.446487 -2.981395 -1.560274
O -3.388852 -0.539448 -0.515653
O 5.879299 -1.700193 0.937997
O 8.159246 2.621436 0.919858
N 0.842779 -1.615624 -0.406906
N 3.501337 -0.467898 -0.219082
C 1.887148 -2.237693 0.447080
C 1.479697 -0.939538 -1.565354
C 2.886094 -1.179494 0.937054
C 2.476270 0.134510 -1.095562
C -0.210697 -2.580352 -0.805369
C -1.535084 -1.892354 -1.181412
C 4.677112 0.299979 0.051379
C -2.110210 -1.085288 -0.015355
C 5.838495 -0.316085 0.620513
C 4.768863 1.689561 -0.245881
C 6.989366 0.434581 0.932214
C 5.927553 2.442123 0.030832
C 7.034766 1.817356 0.641710
C -4.182284 0.210869 0.368180
C -5.433937 0.676459 -0.179063
C -6.312944 1.446859 0.674999
C -3.817365 0.502974 1.687675
C 5.843455 -2.593105 -0.243258
C -5.827767 0.400213 -1.527734
C -5.919532 1.733049 2.025620
C -4.697801 1.270691 2.512623
C -7.562053 1.904809 0.139059
C -7.052674 0.861484 -2.018769
C -7.928163 1.618451 -1.178244
H 1.398843 -2.705600 1.321483
H 2.444582 -3.036622 -0.105240
H 0.700972 -0.455354 -2.181854
H 2.019126 -1.677062 -2.213022
H 3.685673 -1.659288 1.524027
H 2.350822 -0.452800 1.591159
H 1.909335 0.942168 -0.572884
H 2.970465 0.575700 -1.979832
H 0.096249 -3.225066 -1.663425
H -0.413697 -3.256016 0.046587
H -1.396133 -1.205261 -2.043614
H -2.305200 -1.744865 0.854491
H -1.419678 -0.271587 0.274134
H 3.908250 2.206128 -0.680772
H -3.353072 -2.588464 -1.653489
H 7.839778 -0.094146 1.379684
H 5.977096 3.510176 -0.199314
H -2.867190 0.155665 2.102137
H 5.835800 -3.617091 0.161241
H 4.937151 -2.403236 -0.846935
H 6.748771 -2.438367 -0.860860
H -5.149734 -0.171938 -2.167254
H -6.590388 2.318005 2.664582
H -4.395978 1.490706 3.542416
H 8.868181 2.090081 1.359146
H -8.229202 2.487174 0.785747
H -7.346058 0.645448 -3.051951
H -8.886290 1.973874 -1.573362


