%chk=000013332.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013332

0 1
 O    1.049000       1.896800      -1.405300    
 O    2.207000      -1.457100       1.606500    
 O   -2.028500      0.2693000       1.681800    
 N    1.657400      0.1651000      1.8999999E-02
 N  -0.5575000       1.057300      4.8599999E-02
 C    3.026300      0.2900000     -0.4202000    
 C   -1.470400       2.099300     -0.3556000    
 C    3.933700      0.6981000      0.7434000    
 C    3.502700      -1.012300      -1.067900    
 C   -2.740600       1.500500     -0.9654000    
 C   -1.797900       3.014000      0.8270000    
 C  -0.1003000      -1.040900       1.211700    
 C    5.395700      0.7833000      0.3130000    
 C    4.965800     -0.9259000      -1.494900    
 C   -3.743900       2.584400      -1.350700    
 C   -2.803700       4.095300      0.4403000    
 C    5.867900     -0.5153000     -0.3345000    
 C   -4.067400       3.496500     -0.1707000    
 C   0.7344000       1.088600     -0.5246000    
 C    1.368100     -0.7951000      0.9938000    
 C  -0.9874000      0.1610000       1.032200    
 C  -0.5659000      -2.150100      0.2713000    
 C   -2.019200      -2.528600      0.5402000    
 C   -2.491100      -3.617500     -0.4248000    
 C   -3.936200      -4.025300     -0.1392000    
 C   -4.398000      -5.131200      -1.074800    
 H    3.115200       1.073700      -1.182000    
 H   -1.014100       2.728800      -1.128900    
 H    3.615900       1.674500       1.131000    
 H    3.889900      1.1700000E-02   1.592200    
 H    3.399900      -1.873300     -0.3997000    
 H    2.883200      -1.236000      -1.945800    
 H   -2.481500      0.9141000      -1.856100    
 H   -3.243700      0.8071000     -0.2841000    
 H   -2.214400       2.485900       1.687500    
 H  -0.8776000       3.492200       1.186300    
 H  -0.2101000      -1.362000       2.256400    
 H    5.519000       1.610300     -0.3972000    
 H    6.024400       1.013700       1.180600    
 H    5.292600      -1.893500      -1.892300    
 H    5.065400     -0.1976000      -2.309200    
 H   -3.335300       3.183800      -2.173600    
 H   -4.664700       2.120500      -1.722100    
 H   -3.065700       4.690100       1.322700    
 H   -2.341400       4.781900     -0.2796000    
 H    5.880200      -1.313900      0.4175000    
 H    6.897000     -0.3965000     -0.6916000    
 H   -4.606400       2.924600      0.5948000    
 H   -4.735600       4.300800     -0.4985000    
 H  -0.4587000      -1.833800     -0.7748000    
 H   7.3100001E-02  -3.034100      0.3939000    
 H   -2.686300      -1.672200      0.4061000    
 H   -2.128200      -2.874900       1.575000    
 H   -1.839000      -4.494800     -0.3341000    
 H   -2.407300      -3.257900      -1.457600    
 H   -4.028300      -4.371200      0.8969000    
 H   -4.597300      -3.158200     -0.2519000    
 H   -3.777400      -6.025800     -0.9615000    
 H   -5.434100      -5.406400     -0.8539000    
 H   -4.347700      -4.807700      -2.119300    


%chk=000013332-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000013332

0 1
O 1.074902 1.961854 -1.240713
O 2.080791 -1.693982 1.503706
O -2.209972 0.256714 1.617957
N 1.617614 0.125620 0.103538
N -0.631230 1.086819 0.100098
C 3.060519 0.267799 -0.323390
C -1.516518 2.238614 -0.317060
C 3.983575 0.627375 0.867070
C 3.556682 -0.979429 -1.094479
C -2.835202 1.756042 -0.967022
C -1.762364 3.222255 0.853677
C -0.252036 -1.117584 1.185695
C 5.430447 0.846736 0.359397
C 5.005801 -0.745726 -1.589221
C -3.654402 2.979259 -1.450525
C -2.595048 4.431484 0.361052
C 5.950012 -0.388126 -0.416178
C -3.919705 3.973948 -0.295328
C 0.701716 1.093501 -0.405624
C 1.240328 -0.913877 0.977595
C -1.105566 0.126952 1.021823
C -0.742536 -2.250797 0.205546
C -2.119971 -2.835256 0.583457
C -2.582564 -3.919958 -0.415650
C -3.928923 -4.567106 -0.016787
C -4.399160 -5.642738 -1.019128
H 3.050911 1.122059 -1.023533
H -0.926073 2.764005 -1.088996
H 3.609226 1.543770 1.362990
H 3.966277 -0.190425 1.608623
H 3.529274 -1.864025 -0.433678
H 2.885735 -1.174731 -1.953362
H -2.605796 1.087263 -1.819345
H -3.428818 1.181692 -0.234126
H -2.299927 2.701762 1.666002
H -0.790621 3.567368 1.256684
H -0.394700 -1.489950 2.214733
H 5.460636 1.734637 -0.305806
H 6.092529 1.067967 1.218277
H 5.368078 -1.651700 -2.111665
H 5.017451 0.079236 -2.331406
H -3.103070 3.499969 -2.260917
H -4.610950 2.632604 -1.886369
H -2.800752 5.109284 1.211402
H -2.004674 5.012887 -0.377338
H 6.016249 -1.252532 0.275454
H 6.972553 -0.197193 -0.795080
H -4.557354 3.485027 0.469199
H -4.480978 4.851038 -0.671288
H -0.763360 -1.858012 -0.831037
H 0.019283 -3.053309 0.238636
H -2.876436 -2.029712 0.638714
H -2.058781 -3.273372 1.600615
H -1.807486 -4.711181 -0.493348
H -2.677307 -3.475493 -1.428682
H -3.830165 -5.016936 0.992039
H -4.701487 -3.776321 0.070529
H -3.656698 -6.458834 -1.103434
H -5.360268 -6.091731 -0.708245
H -4.538688 -5.211404 -2.028451


