%chk=000162165.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162165

0 1
 O   0.4053000     -0.1101000       1.109900    
 N    3.866800     -0.3160000     -0.1458000    
 C   -1.965700      -3.124900     -0.9532000    
 C   -2.617400      -3.150100      0.3873000    
 C   -1.269900      -2.494400      0.2256000    
 C   -2.920800      -1.079000     -0.5503000    
 C   -2.610900      -2.014900      -1.762000    
 C   -3.668400      -2.055800      0.4126000    
 C   -1.544100      -1.049500      0.1201000    
 C  -0.8285000      1.2600000E-02  0.4896000    
 C   -1.277500       1.409600      0.2992000    
 C    1.442300     -0.1230000      0.1518000    
 C   -2.009900       2.022600       1.298800    
 C  -0.9530000       2.066300     -0.8733000    
 C    2.778600     -0.2648000      0.8572000    
 C   -2.432900       3.339600       1.119500    
 C   -1.376000       3.383400      -1.052600    
 C   -2.115900       4.020000     -5.6200001E-02
 C    5.147600     -0.4881000      0.5252000    
 C    3.853200      0.8977000     -0.9501000    
 C    5.169500      -1.748900       1.364300    
 C    4.927600      0.8679000      -2.017600    
 H   -1.599100      -4.005200      -1.443200    
 H   -2.763200      -4.050200      0.9509000    
 H  -0.3747000      -2.908200      0.6540000    
 H   -3.419300     -0.1375000     -0.7751000    
 H   -3.517500      -2.355100      -2.271400    
 H   -1.912300      -1.568600      -2.477100    
 H   -3.806400      -1.641800       1.416700    
 H   -4.623800      -2.398000      3.4000000E-03
 H    1.301200     -0.9473000     -0.5599000    
 H    1.395300      0.8265000     -0.3815000    
 H   -2.262500       1.502100       2.218500    
 H  -0.3917000       1.580300      -1.666300    
 H    2.919800      0.5557000       1.573300    
 H    2.720600      -1.189200       1.441600    
 H   -3.009400       3.835300       1.895100    
 H   -1.132500       3.912000      -1.969500    
 H   -2.446100       5.045100     -0.1962000    
 H    5.951700     -0.6068000     -0.2087000    
 H    5.402600      0.3755000       1.152700    
 H    2.928200      0.9895000      -1.524800    
 H    3.960200       1.802800     -0.3392000    
 H    4.783200      -2.613500      0.8134000    
 H    4.610500      -1.642400       2.299100    
 H    6.202200      -1.981900       1.648300    
 H    4.918800     -7.3500000E-02  -2.578000    
 H    5.929700       1.026200      -1.607100    
 H    4.755900       1.676400      -2.737500    


%chk=000162165-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162165

0 1
O 0.329283 -0.413741 0.776364
N 4.008002 0.094475 0.268644
C -2.483471 -3.496137 -0.543171
C -2.900904 -3.179003 0.902839
C -1.530310 -2.656681 0.366827
C -3.244271 -1.293816 -0.431314
C -3.216664 -2.487677 -1.449043
C -3.869993 -1.984230 0.833554
C -1.766635 -1.228905 -0.014370
C -0.913412 -0.173380 0.107677
C -1.186965 1.238748 -0.275141
C 1.548252 -0.095314 -0.008502
C -0.727393 2.297304 0.558768
C -1.881524 1.573542 -1.470336
C 2.741922 -0.299482 0.934657
C -0.980012 3.643779 0.223080
C -2.137994 2.921237 -1.803603
C -1.691807 3.963517 -0.957865
C 5.159713 -0.777137 0.619373
C 4.300253 1.547056 0.402632
C 5.101940 -2.150936 -0.075344
C 5.168243 2.096046 -0.745838
H -2.217589 -4.502926 -0.869677
H -2.952253 -3.942429 1.680723
H -0.574362 -3.023880 0.734699
H -3.726097 -0.365645 -0.760465
H -4.231540 -2.824506 -1.730331
H -2.646389 -2.247184 -2.364516
H -3.814725 -1.338048 1.727434
H -4.919769 -2.289268 0.667215
H 1.619947 -0.775150 -0.879434
H 1.504309 0.948223 -0.378552
H -0.187040 2.043665 1.477996
H -2.193495 0.774667 -2.152016
H 2.558814 0.269559 1.877084
H 2.787438 -1.366330 1.215804
H -0.627049 4.444431 0.883225
H -2.672255 3.158979 -2.730632
H -1.887125 5.009456 -1.219737
H 6.082924 -0.261272 0.298093
H 5.245278 -0.916720 1.727174
H 3.333831 2.085232 0.399422
H 4.783678 1.775978 1.386708
H 5.088127 -2.020907 -1.171449
H 4.197261 -2.718147 0.210499
H 5.981631 -2.762643 0.200249
H 4.670410 1.917313 -1.714679
H 6.161686 1.613168 -0.780232
H 5.329503 3.183520 -0.622995


