%chk=000132599.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132599

0 1
 O    3.785200       2.958000      0.1405000    
 N   -1.613200      -1.651700      0.1944000    
 N    2.388000      -2.317700     -0.4415000    
 C   0.7244000     -0.9769000      0.1965000    
 C  -0.6561000     -0.6013000      0.6215000    
 C    1.067200      -2.275700     -0.1071000    
 C   0.1305000      -3.425200     -0.1014000    
 C   -1.176600      -3.005700      0.6087000    
 C    1.898300     -0.1861000      4.8599999E-02
 C    2.924500      -1.049900     -0.3531000    
 C   -2.945600      -1.358600      0.7230000    
 C    2.193300       1.181900      0.2184000    
 C   -3.464000     -3.5799999E-02  0.2377000    
 C    4.229900     -0.6071000     -0.5958000    
 C    3.495000       1.636300     -2.1400001E-02
 C    4.495800      0.7540000     -0.4224000    
 C   -3.202800       1.116100      0.9708000    
 C   -4.200400      2.4200000E-02 -0.9395000    
 C   -3.684800       2.345000      0.5202000    
 C   -4.682300       1.253100      -1.390300    
 C   -4.424600       2.413500     -0.6603000    
 C    2.718100       3.809500      0.5524000    
 H  -0.6659000     -0.4649000       1.710200    
 H  -0.8768000      0.3522000      0.1321000    
 H  -8.8799998E-02  -3.714900      -1.136100    
 H   0.5700000      -4.289800      0.4071000    
 H   -1.944800      -3.748500      0.3610000    
 H   -1.034400      -3.038200       1.697700    
 H    2.899200      -3.145900     -0.7148000    
 H   -2.952300      -1.379400       1.821900    
 H   -3.650800      -2.140600      0.4104000    
 H    1.376900       1.821100      0.5316000    
 H    5.011000      -1.292700     -0.9069000    
 H    5.502700       1.122600     -0.6045000    
 H   -2.641600       1.078700       1.900200    
 H   -4.405800     -0.8725000      -1.517700    
 H   -3.486900       3.248100       1.090200    
 H   -5.258000       1.306700      -2.309700    
 H   -4.800500       3.370300      -1.010900    
 H    1.918600       3.845200     -0.1955000    
 H    3.125600       4.822800      0.6307000    
 H    2.346400       3.538500       1.546500    


%chk=000132599-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000132599

0 1
O 4.175158 2.857057 0.044521
N -1.608629 -1.541860 0.444971
N 2.329623 -2.376385 -0.665372
C 0.767868 -0.951743 0.190198
C -0.570119 -0.508888 0.720550
C 1.006324 -2.263569 -0.212727
C -0.011754 -3.365513 -0.165870
C -1.156726 -2.916054 0.777294
C 1.991008 -0.204920 -0.011255
C 2.958143 -1.124848 -0.551885
C -2.910649 -1.195551 1.054645
C 2.358292 1.152191 0.208075
C -3.571490 0.023206 0.412614
C 4.272690 -0.721057 -0.870701
C 3.672910 1.547027 -0.116093
C 4.622501 0.622041 -0.648078
C -4.345453 0.914579 1.195158
C -3.462905 0.252669 -0.982294
C -5.010792 2.009691 0.596550
C -4.121132 1.348543 -1.582127
C -4.900918 2.230007 -0.795660
C 3.255643 3.861238 0.572262
H -0.502264 -0.300545 1.822417
H -0.891116 0.436404 0.243166
H -0.426006 -3.565360 -1.174263
H 0.423131 -4.313950 0.209880
H -2.018667 -3.598714 0.663081
H -0.803388 -2.992930 1.837347
H 2.762937 -3.226982 -1.017065
H -2.828077 -1.022771 2.159498
H -3.577632 -2.071753 0.922585
H 1.630153 1.859720 0.615862
H 5.008147 -1.421549 -1.281671
H 5.625905 0.992455 -0.877899
H -4.427300 0.752955 2.277841
H -2.845931 -0.432142 -1.575232
H -5.607043 2.690843 1.214676
H -4.026549 1.517016 -2.661199
H -5.412430 3.080040 -1.261526
H 2.376010 3.993143 -0.089285
H 3.834704 4.796238 0.608233
H 2.909428 3.598722 1.592176


