%chk=000121301.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121301

0 1
 O   0.4334000      -1.497500     -0.7635000    
 O   -1.444700      -3.145800      0.4256000    
 O    2.903800      -1.096500      -1.468800    
 N   0.4346000       1.951300     -0.7415000    
 N    3.729300     -0.6344000      0.6517000    
 C    1.413100       2.844900      -1.360700    
 C  -0.4962000       2.835100     -4.0100001E-02
 C    1.679800       3.869100     -0.2674000    
 C   0.4265000       3.860100      0.6025000    
 C  -0.2338000       1.099700      -1.714100    
 C   -1.237700      0.1856000      -1.063400    
 C  -0.8541000      -1.072300     -0.6178000    
 C   -2.547800      0.6241000     -0.9200000    
 C   -3.490800     -0.2107000     -0.3204000    
 C   -1.797200      -1.906900     -1.8100001E-02
 C   -3.115500      -1.476300      0.1305000    
 C   -4.900000      0.2497000     -0.1593000    
 C    1.334600      -1.208500      0.3026000    
 C    2.724200     -0.9782000     -0.2528000    
 C   -5.141000      0.9671000       1.143600    
 C    5.081500     -0.3943000      0.1627000    
 C    3.552600     -0.4708000       2.092400    
 C   -1.566400      -4.224500     -0.4994000    
 C    5.902800      -1.667000      0.1544000    
 C    3.190600      0.9563000       2.448500    
 C   -5.981800      0.5406000       2.092700    
 H    2.327600       2.317300      -1.649800    
 H    1.003400       3.347200      -2.246300    
 H   -1.179400       3.347100     -0.7299000    
 H   -1.079100       2.324100      0.7324000    
 H    2.550300       3.579800      0.3331000    
 H    1.875500       4.861400     -0.6861000    
 H  -4.1400000E-02   4.848700      0.6496000    
 H   0.6882000       3.562900       1.624900    
 H   0.5066000      0.5025000      -2.261400    
 H  -0.7388000       1.697400      -2.486800    
 H   -2.846600       1.605300      -1.279800    
 H   -3.845800      -2.130600      0.6006000    
 H   -5.166700      0.9263000     -0.9817000    
 H   -5.580300     -0.6060000     -0.2633000    
 H    1.359200      -2.080100      0.9647000    
 H    1.011700     -0.3305000      0.8698000    
 H    5.563800      0.3734000      0.7776000    
 H    5.028100      9.9999997E-05 -0.8585000    
 H    2.760800      -1.139100       2.442400    
 H    4.471500     -0.7734000       2.606600    
 H   -4.603700       1.898300       1.307600    
 H   -1.241700      -5.141800     -6.0000003E-04
 H   -2.608300      -4.345800     -0.8121000    
 H  -0.9287000      -4.056800      -1.373100    
 H    6.909000      -1.468600     -0.2274000    
 H    5.441900      -2.431000     -0.4805000    
 H    5.997600      -2.085700       1.161500    
 H    2.267200       1.274400       1.955900    
 H    3.049000       1.053700       3.529400    
 H    3.979700       1.652700       2.147000    
 H   -6.114100       1.110300       3.006000    
 H   -6.547400     -0.3773000       1.977800    


%chk=000121301-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121301

0 1
O 0.439821 -0.877241 -0.959837
O -1.203651 -2.789758 0.447701
O 2.717058 -2.355319 -0.956385
N 0.263683 2.429331 -0.814732
N 3.743731 -1.035559 0.661868
C 1.227062 3.337929 -1.504296
C -0.468012 3.307506 0.138203
C 1.701608 4.324230 -0.397418
C 0.664014 4.153203 0.763148
C -0.598530 1.677132 -1.767192
C -1.476565 0.642170 -1.082574
C -0.918513 -0.594596 -0.674188
C -2.848241 0.885363 -0.831088
C -3.662478 -0.064300 -0.165888
C -1.726400 -1.570362 -0.024777
C -3.085468 -1.292851 0.235290
C -5.148311 0.214322 0.074416
C 1.320875 -0.700463 0.207963
C 2.643595 -1.427726 -0.092173
C -5.629076 -0.167632 1.462507
C 5.037885 -1.719902 0.421635
C 3.706038 0.003466 1.716673
C -0.539838 -3.668291 -0.555773
C 5.241061 -2.945635 1.337614
C 4.085271 1.410769 1.203785
C -6.665662 -1.002783 1.724325
H 2.048752 2.753358 -1.955590
H 0.723073 3.904582 -2.327953
H -1.198819 3.968741 -0.397353
H -1.031046 2.708108 0.873082
H 2.721278 4.084321 -0.050138
H 1.719350 5.359639 -0.779863
H 0.292443 5.118539 1.148460
H 1.119105 3.603766 1.606080
H 0.074950 1.167982 -2.479655
H -1.247039 2.382359 -2.347748
H -3.284258 1.840128 -1.152761
H -3.682638 -2.053468 0.749489
H -5.334380 1.294866 -0.092790
H -5.758507 -0.327686 -0.675877
H 0.850752 -1.156032 1.105237
H 1.446170 0.388028 0.364928
H 5.848268 -0.981446 0.572302
H 5.051818 -2.040696 -0.633496
H 2.705335 0.025785 2.182407
H 4.407941 -0.306761 2.514149
H -5.074720 0.284434 2.299296
H -0.265283 -4.573660 0.007205
H -1.259650 -3.926192 -1.355879
H 0.356932 -3.188696 -0.982697
H 6.225546 -3.410294 1.144488
H 4.458983 -3.698534 1.141479
H 5.200036 -2.666365 2.406921
H 3.361491 1.758447 0.446125
H 4.091351 2.136649 2.038343
H 5.090309 1.406880 0.745023
H -6.975007 -1.231758 2.750245
H -7.234595 -1.481925 0.917235


