%chk=000086123.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086123

0 1
 O   1.7800000E-02  -1.741200      0.2595000    
 O    3.356800       2.537000     -0.2923000    
 O   -3.711900       2.145500     -0.2923000    
 N    2.317600     -3.7900001E-02  0.3334000    
 N   -2.434800     -0.3274000      0.3036000    
 C    2.402100      -1.496500      0.3659000    
 C    1.227500      -2.158000     -0.3589000    
 C    3.402300      0.5652000       1.120300    
 C    2.363700      0.4568000      -1.049600    
 C   -2.373400      -1.787600      0.3016000    
 C   -3.592700      0.1451000       1.075400    
 C   -2.498000      0.1939000      -1.068800    
 C   -1.119400      -2.271000     -0.4091000    
 C    3.300000       2.086700       1.061700    
 C    2.286900       1.981000      -1.057400    
 C   -3.643200       1.670100       1.052600    
 C   -2.573300       1.717800      -1.040700    
 C    1.272000      -3.679700     -0.3050000    
 H    2.379200      -1.821000       1.414700    
 H    3.349700      -1.847100     -6.3500002E-02
 H    1.222600      -1.879900      -1.418200    
 H    3.337500      0.2457000       2.166600    
 H    4.377900      0.2502000      0.7277000    
 H    3.288900      0.1329000      -1.543400    
 H    1.513800      0.1072000      -1.641700    
 H   -3.261700      -2.229100     -0.1672000    
 H   -2.335500      -2.139200       1.340600    
 H   -3.520400     -0.1918000       2.115800    
 H   -4.522100     -0.2567000      0.6512000    
 H   -1.605000     -5.6600001E-02  -1.647900    
 H   -3.375400     -0.2074000      -1.592300    
 H   -1.147400      -3.361700     -0.3183000    
 H   -1.103600      -2.034400      -1.477600    
 H    2.376100       2.448500       1.529500    
 H    4.141100       2.537700       1.597800    
 H    2.382500       2.354400      -2.082100    
 H    1.328600       2.340100     -0.6620000    
 H   -2.772300       2.111300       1.552700    
 H   -4.538400       2.021300       1.575700    
 H   -2.680700       2.105100      -2.059000    
 H   -1.665700       2.160300     -0.6118000    
 H    2.285800      -4.040300     -0.5116000    
 H   0.9678000      -4.060600      0.6762000    
 H   0.6296000      -4.140100      -1.062900    


%chk=000086123-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000086123

0 1
O 0.073414 -2.139499 0.273954
O 2.798127 2.654723 -0.073324
O -3.429920 2.458890 0.376375
N 2.398081 -0.202763 -0.464273
N -2.285315 -0.210080 0.523104
C 2.411266 -1.651529 -0.154294
C 1.176436 -2.407770 -0.678398
C 1.495458 0.589327 0.418832
C 3.759096 0.393239 -0.457960
C -2.272261 -1.685193 0.664860
C -2.804471 0.476014 1.735321
C -3.021977 0.250422 -0.681784
C -1.267357 -2.384578 -0.259450
C 1.453833 2.046878 -0.058025
C 3.687703 1.855856 -0.930341
C -2.693426 1.999889 1.565808
C -2.907822 1.777315 -0.819045
C 1.435353 -3.922387 -0.804620
H 2.502422 -1.854716 0.942247
H 3.303842 -2.087894 -0.642894
H 0.906006 -1.978240 -1.668472
H 0.482540 0.152681 0.396573
H 1.858125 0.561896 1.478444
H 4.222552 0.364538 0.561419
H 4.411075 -0.179013 -1.146369
H -3.287759 -2.124809 0.488176
H -1.986374 -1.931222 1.704315
H -2.204784 0.159322 2.609300
H -3.874575 0.211948 1.933635
H -2.593192 -0.226179 -1.583018
H -4.105143 -0.032079 -0.626914
H -1.489332 -3.474543 -0.279456
H -1.341834 -2.002642 -1.301837
H 1.014546 2.091985 -1.079179
H 0.858523 2.672961 0.628072
H 4.674985 2.343945 -0.868208
H 3.321113 1.883845 -1.979831
H -1.622986 2.286851 1.476181
H -3.148957 2.530051 2.418446
H -3.517015 2.148270 -1.659772
H -1.843495 2.057934 -0.975609
H 2.218647 -4.123403 -1.559019
H 1.764921 -4.341014 0.163708
H 0.522828 -4.460629 -1.117780


