%chk=000123696.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000123696

0 1
 O    3.984200       1.581300     -0.3882000    
 N   -2.342900      0.2615000      0.2665000    
 C  -0.9125000      0.2526000     -3.6499999E-02
 C  -0.1784000     -0.9100000      0.6756000    
 C  -0.2866000       1.599700      0.3325000    
 C    1.169500       1.657200     -0.1274000    
 C    1.324000     -0.8229000      0.4545000    
 C    1.952100      0.3929000      0.1241000    
 C  -0.4621000     -0.9898000       2.185600    
 C   -2.946700      -1.023100     -8.3999999E-02
 C   -3.008400       1.351400     -0.4458000    
 C    2.109100      -1.978100      0.6144000    
 C    3.345900      0.4241000     -4.5699999E-02
 C   -2.776500      -1.361000      -1.560200    
 C   -4.501100       1.415000     -0.1455000    
 C    3.492700      -1.930700      0.4492000    
 C    4.111300     -0.7293000      0.1203000    
 C   -3.421300      -2.687000      -1.938300    
 C   -4.794800       1.653000       1.329000    
 C    4.142300       1.843300      -1.779800    
 H  -0.7455000      0.1531000      -1.117800    
 H  -0.4861000      -1.858700      0.2183000    
 H  -0.3422000       1.768600       1.415100    
 H  -0.7559000       2.463000     -0.1443000    
 H    1.653900       2.506600      0.3694000    
 H    1.179300       1.852600      -1.206800    
 H   -1.529300      -1.060900       2.412500    
 H   1.3400000E-02  -1.874900       2.624400    
 H  -6.4099997E-02 -0.1195000       2.718800    
 H   -2.544100      -1.838900      0.5256000    
 H   -4.006900      -1.053800      0.1880000    
 H   -2.644200       2.323500     -0.1027000    
 H   -2.840900       1.332000      -1.528700    
 H    1.642600      -2.925800      0.8735000    
 H   -3.228000     -0.6017000      -2.205800    
 H   -1.724900      -1.450700      -1.847100    
 H   -4.913600       2.266700     -0.7032000    
 H   -5.053300      0.5465000     -0.5166000    
 H    4.086100      -2.831300      0.5771000    
 H    5.189600     -0.6985000     -1.0700000E-02
 H   -4.497400      -2.669200      -1.738100    
 H   -3.277300      -2.891600      -3.004000    
 H   -2.979400      -3.512200      -1.370800    
 H   -4.289900       2.553600       1.693100    
 H   -5.870800       1.789000       1.478500    
 H   -4.478900      0.8066000       1.946400    
 H    4.469200       2.879900      -1.898200    
 H    3.205200       1.707800      -2.327900    
 H    4.911500       1.185700      -2.197100    


%chk=000123696-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000123696

0 1
O 3.823658 1.769383 -0.812528
N -2.461674 0.253354 0.100441
C -1.000286 0.317999 -0.232856
C -0.202218 -0.813053 0.492265
C -0.353795 1.677950 0.130113
C 1.096803 1.763646 -0.395008
C 1.295333 -0.730048 0.183236
C 1.903496 0.491932 -0.193762
C -0.428589 -0.819562 2.031567
C -3.075697 -1.084659 -0.125835
C -3.271080 1.359919 -0.480902
C 2.090771 -1.899793 0.319780
C 3.310383 0.512844 -0.426462
C -3.095645 -1.618036 -1.587446
C -4.725359 1.432630 0.043838
C 3.478525 -1.858317 0.094829
C 4.104665 -0.645977 -0.279329
C -3.802354 -2.987799 -1.678780
C -4.812528 1.563022 1.579177
C 5.264793 1.870383 -1.042024
H -0.845077 0.172884 -1.335799
H -0.549932 -1.789937 0.101123
H -0.386174 1.811094 1.227415
H -0.913196 2.521324 -0.309387
H 1.622499 2.614137 0.077575
H 1.086337 2.001392 -1.479205
H -1.506375 -0.798878 2.267501
H 0.026287 -1.719423 2.483778
H 0.039192 0.060522 2.506995
H -2.562157 -1.826364 0.513752
H -4.116166 -1.047560 0.247582
H -2.788819 2.314259 -0.210412
H -3.292997 1.321145 -1.600807
H 1.609734 -2.843890 0.602674
H -3.609955 -0.891324 -2.246790
H -2.059575 -1.711416 -1.967832
H -5.198986 2.314257 -0.433534
H -5.311540 0.556300 -0.295215
H 4.081960 -2.766550 0.203126
H 5.183997 -0.622112 -0.455687
H -4.852205 -2.918323 -1.335182
H -3.812220 -3.370660 -2.715611
H -3.293772 -3.741010 -1.046979
H -4.303397 2.482878 1.923647
H -5.863600 1.604703 1.919819
H -4.313561 0.710385 2.071721
H 5.440688 2.921515 -1.315497
H 5.589289 1.210496 -1.870460
H 5.838421 1.621939 -0.127423


