%chk=000174460.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000174460

0 1
 O   -7.009700       2.059500     -0.8128000    
 O   -1.959400      -1.770900      0.4025000    
 O    3.673100       1.487300     -9.8499998E-02
 O    8.745200      -2.503000      -1.146200    
 N   -4.153400       2.634900     -0.3169000    
 N    6.537300       1.747900      0.4722000    
 N   -1.372500      0.4634000      8.2900003E-02
 N    3.897800     -0.8064000      0.2573000    
 N   -6.798500      0.2586000      0.5983000    
 N   0.8040000      -2.525800      0.5407000    
 N    9.289900     -0.3367000     -0.3562000    
 N   -6.906100      -2.517000      -1.008800    
 N   -8.553800      -3.188800      0.5423000    
 C   -4.817000       1.446500     -0.1573000    
 C   -2.599700       1.072000     -4.1900001E-02
 C   -3.874600      0.4569000      1.5799999E-02
 C   -2.801700       2.418800     -0.2483000    
 C    5.858100      0.6273000      7.0699997E-02
 C   0.3364000      -1.252900      0.3432000    
 C    2.587800      -1.220100      0.3268000    
 C   -6.279100       1.298200     -0.1761000    
 C    1.425000     -0.4198000      0.2069000    
 C   -4.768800       3.927500     -0.5229000    
 C   -1.094300     -0.9043000      0.2959000    
 C    6.787600     -0.3195000     -0.2994000    
 C    8.070600      0.2519000     -0.1140000    
 C    4.390400      0.5006000      5.2099999E-02
 C   -8.210900      8.2999999E-03  0.7041000    
 C    7.886200       1.530600      0.3639000    
 C    2.174400      -2.517900      0.5326000    
 C   -8.709500     -0.9552000     -0.3647000    
 C    5.938900       2.977300      0.9439000    
 C   -8.028700      -2.307000     -0.2517000    
 C    9.535100      -1.622200     -0.8365000    
 H   -4.097600     -0.5909000      0.1589000    
 H   -2.098400       3.234900     -0.3515000    
 H  -0.5919000       1.108200      4.4000000E-03
 H    1.388200      0.6462000      3.9500002E-02
 H   -4.005100       4.707400     -0.4589000    
 H   -5.516900       4.090600      0.2569000    
 H   -5.223700       3.939500      -1.516300    
 H    6.557900      -1.308700     -0.6701000    
 H   -8.756300      0.9555000      0.6342000    
 H   -8.385000     -0.4063000       1.703100    
 H    8.600300       2.297900      0.6334000    
 H    4.576600      -1.552300      0.3892000    
 H   -6.171600     -0.3403000       1.126900    
 H   0.2282000      -3.346100      0.6724000    
 H    2.728300      -3.435800      0.6744000    
 H   -8.527700     -0.5468000      -1.365800    
 H   -9.791000      -1.096900     -0.2573000    
 H    5.446000       3.468000      0.1011000    
 H    5.226000       2.741600       1.738000    
 H    6.719500       3.630400       1.343300    
 H    10.10140      0.2436000     -0.1578000    
 H    10.62410      -1.781800     -0.9174000    
 H   -6.410900      -3.401700     -0.9789000    
 H   -6.525700      -1.796500      -1.613400    
 H   -7.988000      -4.043700      0.5055000    


%chk=000174460-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000174460

0 1
O -7.396968 2.307663 -0.476691
O -2.114861 -1.454713 0.165971
O 3.765645 1.584495 0.181858
O 8.531323 -2.945122 -0.531700
N -4.490694 2.932268 -0.025656
N 6.699805 1.655587 0.282237
N -1.536382 0.829396 0.132366
N 3.869921 -0.757535 0.216938
N -6.979001 0.225955 0.497030
N 0.559064 -2.197528 0.212420
N 9.362149 -0.759994 -0.249839
N -6.144341 -2.544161 -0.629678
N -8.068179 -3.625441 0.391242
C -5.104243 1.675391 0.076329
C -2.832977 1.387194 0.105830
C -4.085534 0.699575 0.153745
C -3.110674 2.765928 0.001837
C 5.932437 0.490723 0.121724
C 0.206714 -0.850893 0.183598
C 2.484657 -1.028534 0.209577
C -6.571611 1.459729 0.011075
C 1.396990 -0.092883 0.182298
C -5.161493 4.245925 -0.053519
C -1.230901 -0.525310 0.160423
C 6.820248 -0.587498 -0.101735
C 8.145788 -0.056808 -0.070242
C 4.455383 0.507745 0.175200
C -8.331666 -0.308847 0.299474
C 8.044800 1.329343 0.170053
C 1.936025 -2.331870 0.228843
C -8.365631 -1.474760 -0.732607
C 6.205999 3.021131 0.542633
C -7.503125 -2.655129 -0.296143
C 9.488566 -2.124443 -0.463555
H -4.192525 -0.380646 0.198999
H -2.437425 3.619305 -0.055691
H -0.750105 1.481642 0.118829
H 1.520757 0.986806 0.166973
H -4.608152 4.924686 -0.724138
H -5.198100 4.686987 0.959264
H -6.186503 4.104090 -0.426747
H 6.584848 -1.630644 -0.297615
H -8.959921 0.525800 -0.054750
H -8.733554 -0.672190 1.262887
H 8.820337 2.086899 0.267232
H 4.496047 -1.563047 0.262036
H -6.282008 -0.388462 0.921889
H -0.148678 -2.933856 0.219530
H 2.426700 -3.302475 0.248991
H -8.046892 -1.092796 -1.720732
H -9.403059 -1.837091 -0.814514
H 5.596435 3.380179 -0.300528
H 5.571414 3.038239 1.442313
H 7.076287 3.682070 0.689242
H 10.226400 -0.214447 -0.219124
H 10.554676 -2.427592 -0.571749
H -5.480317 -3.277347 -0.382297
H -5.817118 -1.805566 -1.251166
H -7.399976 -4.371120 0.683231


