%chk=000170757.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170757

0 1
 O   -8.588600     -0.6710000     -1.1300000E-02
 N   -1.340500     -0.4755000     -7.5700000E-02
 N    2.296500      0.3118000      0.1286000    
 N   -4.994300      0.1984000      0.2246000    
 N    5.950300     -0.3766000     -0.1259000    
 N    9.586700      0.4242000      3.2299999E-02
 C  -0.1504000      0.3203000      0.1887000    
 C    1.104200     -0.4914000     -0.1194000    
 C   -2.550100      0.2844000      0.2206000    
 C   -3.786900     -0.5540000     -8.8100001E-02
 C    3.504000     -0.4573000     -0.1356000    
 C   -6.186800     -0.5830000     -7.3600002E-02
 C    4.740100      0.3994000      0.1215000    
 C   -7.471900      0.1668000      0.2859000    
 C    7.139700      0.4348000      8.9599997E-02
 C   -7.646900       1.462400     -0.4961000    
 C    8.395100     -0.3937000     -0.1663000    
 H  -0.1343000      0.6287000       1.241700    
 H  -0.1591000       1.229000     -0.4268000    
 H    1.084800     -0.8100000      -1.169300    
 H    1.118300      -1.393600      0.5055000    
 H   -2.574800       1.205300     -0.3759000    
 H   -2.557000      0.5698000       1.280100    
 H   -3.757200      -1.481100      0.4986000    
 H   -3.784000     -0.8290000      -1.150400    
 H    3.534000      -1.346200      0.5076000    
 H    3.508500     -0.7980000      -1.178700    
 H   -1.348900     -0.7702000      -1.051800    
 H    2.298600      0.6365000       1.095200    
 H   -6.213700     -0.8486000      -1.138400    
 H   -6.173300      -1.532100      0.4781000    
 H    4.715400       1.281500     -0.5310000    
 H    4.732000      0.7501000       1.161200    
 H   -4.992600      0.4616000       1.209700    
 H   -7.493000      0.3768000       1.361700    
 H    5.943300     -0.7314000      -1.081900    
 H    7.156700      0.8088000       1.121100    
 H    7.129200       1.303200     -0.5815000    
 H   -7.662900       1.269000      -1.574500    
 H   -6.849500       2.179400     -0.2801000    
 H   -8.604800       1.933300     -0.2489000    
 H    8.395700     -0.7848000      -1.190300    
 H    8.432400      -1.249400      0.5172000    
 H   -9.392300     -0.2012000      0.2700000    
 H    9.579900       1.205800     -0.6219000    
 H    10.41500     -0.1265000     -0.1896000    


%chk=000170757-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170757

0 1
O -8.758238 -0.620486 0.134663
N -1.398297 -0.424572 -0.049490
N 2.323019 0.213329 0.230707
N -5.121049 0.098064 0.395960
N 6.045673 -0.267356 -0.260249
N 9.756216 0.407110 -0.059707
C -0.157005 0.314594 0.266720
C 1.083223 -0.530190 -0.080509
C -2.646127 0.274528 0.324548
C -3.873551 -0.607598 0.027846
C 3.573198 -0.474984 -0.157293
C -6.367430 -0.627302 0.065490
C 4.795735 0.415727 0.133647
C -7.593919 0.284701 0.250604
C 7.285118 0.467636 0.064243
C -7.648410 1.426175 -0.775764
C 8.526028 -0.359917 -0.323227
H -0.160915 0.529767 1.355633
H -0.073725 1.298193 -0.255796
H 1.085116 -0.747468 -1.169062
H 1.003152 -1.512969 0.443881
H -2.783153 1.257469 -0.188660
H -2.600982 0.485665 1.413410
H -3.740055 -1.587522 0.545598
H -3.917560 -0.822361 -1.059780
H 3.722266 -1.459033 0.349486
H 3.520454 -0.680666 -1.246899
H -1.416673 -0.707541 -1.040426
H 2.347646 0.490203 1.223245
H -6.318348 -0.945172 -0.993545
H -6.528617 -1.547994 0.674642
H 4.643588 1.402058 -0.368935
H 4.851377 0.617781 1.223468
H -5.106495 0.373891 1.389214
H -7.566013 0.715326 1.278787
H 6.024097 -0.540055 -1.253970
H 7.315529 0.657419 1.152904
H 7.343654 1.470148 -0.437267
H -7.788742 1.015288 -1.792507
H -6.697089 1.986467 -0.751976
H -8.477185 2.129220 -0.563359
H 8.415407 -0.690729 -1.388558
H 8.539085 -1.276785 0.292683
H -9.583236 -0.073896 0.094283
H 9.854494 1.257874 -0.621147
H 10.615337 -0.147339 -0.037034


