%chk=000156684.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156684

0 1
 O   -1.163800       3.232900     -0.2239000    
 O   -2.399000     -0.3962000       1.879100    
 N   -2.278100       1.162800     -0.4527000    
 C    4.027400     -0.4473000      0.2107000    
 C    2.641800      0.2064000      7.9200000E-02
 C    5.106400      0.5060000     -0.3469000    
 C    4.056300      -1.769100     -0.5870000    
 C    4.424000     -0.7841000       1.666000    
 C    2.196800      0.5431000      -1.174700    
 C    1.913800      0.4254000       1.221800    
 C   0.1710000       1.376200     -0.1550000    
 C   0.9406000       1.137900      -1.293700    
 C   0.6576000       1.020000       1.102800    
 C   -1.139500       1.994900     -0.2784000    
 C   -2.115900     -0.2784000     -0.5000000    
 C   -3.620600       1.751000     -0.5855000    
 C   -2.184900     -0.9860000      0.6688000    
 C   -1.901700     -0.8476000      -1.726700    
 C   -2.027200      -2.370600      0.6074000    
 C   -1.744200      -2.232100      -1.788100    
 C   -1.806700      -2.993600     -0.6210000    
 C   -3.754200     -0.2517000       2.297700    
 H    6.109500      8.0399998E-02 -0.2252000    
 H    4.974500      0.7074000      -1.415600    
 H    5.088800       1.470400      0.1747000    
 H    3.904200      -1.613100      -1.660600    
 H    5.021000      -2.277400     -0.4733000    
 H    3.275200      -2.456300     -0.2403000    
 H    5.417800      -1.247800       1.700600    
 H    4.476000      0.1121000       2.295500    
 H    3.730400      -1.498100       2.125800    
 H    2.777500      0.3678000      -2.073700    
 H    2.242000      0.1707000       2.221300    
 H   0.5722000       1.412900      -2.278700    
 H   6.8899997E-02   1.205600       1.997500    
 H   -4.338000       1.002800     -0.9327000    
 H   -3.573700       2.580500      -1.297000    
 H   -3.921200       2.145500      0.3891000    
 H   -1.854700     -0.2576000      -2.636500    
 H   -2.073600      -2.970200       1.512500    
 H   -1.572700      -2.717200      -2.744500    
 H   -1.683400      -4.071500     -0.6688000    
 H   -3.823200      0.6277000       2.943800    
 H   -4.047800      -1.134500       2.873400    
 H   -4.439800     -0.1255000       1.454000    


%chk=000156684-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000156684

0 1
O -1.097640 3.004141 -1.565872
O -3.258003 0.144179 1.707090
N -2.235841 1.181510 -0.656438
C 4.295149 -0.378711 0.175260
C 2.877568 0.174252 -0.104634
C 5.315147 0.799343 0.205000
C 4.689115 -1.372683 -0.959815
C 4.381790 -1.128540 1.529323
C 2.625188 0.906372 -1.299206
C 1.790794 -0.008341 0.788960
C 0.264723 1.205993 -0.702149
C 1.350110 1.424984 -1.588234
C 0.503350 0.492162 0.496588
C -1.055670 1.853522 -1.022263
C -2.317538 -0.242312 -0.465709
C -3.519414 1.916393 -0.754369
C -2.886522 -0.788971 0.725426
C -1.886426 -1.125697 -1.481514
C -3.022104 -2.189881 0.871429
C -1.997216 -2.525577 -1.329142
C -2.573377 -3.053553 -0.154203
C -3.835730 -0.369181 2.952902
H 6.336465 0.414963 0.387596
H 5.327773 1.354665 -0.749700
H 5.064481 1.515237 1.008943
H 4.679178 -0.884990 -1.950979
H 5.708055 -1.767095 -0.785152
H 3.987744 -2.226447 -0.995977
H 5.410829 -1.503957 1.678387
H 4.141357 -0.464577 2.380297
H 3.700277 -1.998803 1.561990
H 3.439402 1.082593 -2.011619
H 1.941430 -0.544408 1.730481
H 1.177180 2.018850 -2.491940
H -0.309500 0.350385 1.216171
H -4.117711 1.547083 -1.608458
H -3.287820 2.979777 -0.917637
H -4.089032 1.784172 0.179818
H -1.460098 -0.697960 -2.395136
H -3.460082 -2.615024 1.779371
H -1.649238 -3.191679 -2.125031
H -2.677477 -4.136856 -0.028467
H -4.037203 0.524243 3.561655
H -3.123354 -1.029912 3.483538
H -4.780309 -0.915166 2.764623


