%chk=000044861.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044861

0 1
 N   -3.448800      -1.535700     -0.2911000    
 N   9.9399999E-02 -0.6523000       3.101300    
 C  -0.9674000      -1.178100     -0.1320000    
 C   0.1873000     -0.2388000      0.4735000    
 C   -2.386800     -0.7830000      0.3753000    
 C  -7.4600004E-02   1.249900      0.1053000    
 C    1.616600     -0.5759000     -4.1600000E-02
 C  -0.7186000      -2.680800      0.1424000    
 C   0.1395000     -0.4641000       1.956000    
 C   0.3045000       2.201100       1.006300    
 C    2.659700     -0.3838000      0.8157000    
 C  -0.6664000       1.510500      -1.095600    
 C    1.735800      -1.042500      -1.317300    
 C   -3.443400      -1.264400      -1.728100    
 C   -4.750600      -1.203800      0.2867000    
 C   6.9799997E-02   3.535800      0.6761000    
 C    3.940800     -0.6860000      0.3542000    
 C  -0.9009000       2.845300      -1.425700    
 C    3.017000      -1.344900      -1.778800    
 C  -0.5327000       3.858000     -0.5398000    
 C    4.119500      -1.166600     -0.9429000    
 H  -0.9493000      -1.094900      -1.217400    
 H   -2.572000      0.2905000      0.2652000    
 H   -2.440900     -0.9939000       1.451000    
 H   0.2851000      -3.001000     -0.1473000    
 H   -1.419600      -3.302300     -0.4253000    
 H  -0.8533000      -2.924200       1.201500    
 H   0.7924000       1.987700       1.950000    
 H    2.568700      1.4600000E-02   1.819100    
 H  -0.9348000      0.7716000      -1.836800    
 H   0.9135000      -1.170400      -2.007800    
 H   -2.596700      -1.734700      -2.235800    
 H   -3.450900     -0.1917000      -1.953300    
 H   -4.330000      -1.705400      -2.200300    
 H   -4.768400      -1.434800       1.357800    
 H   -5.541700      -1.806000     -0.1740000    
 H   -5.003800     -0.1451000      0.1574000    
 H   0.3609000       4.324900       1.363300    
 H    4.800500     -0.5406000       1.002000    
 H   -1.361500       3.097600      -2.376500    
 H    3.157600      -1.712900      -2.790900    
 H  -0.7123000       4.897400     -0.7983000    
 H    5.117300      -1.399100      -1.303300    


%chk=000044861-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000044861

0 1
N -3.460191 -1.382683 -0.336888
N 0.153524 -0.574042 3.126890
C -0.962566 -1.205089 -0.103874
C 0.205134 -0.286151 0.466114
C -2.353253 -0.746216 0.418995
C -0.045888 1.208015 0.087422
C 1.613261 -0.697153 -0.062746
C -0.758894 -2.703583 0.205718
C 0.192533 -0.436989 1.942612
C -0.366880 2.190742 1.055820
C 2.765980 -0.403922 0.708561
C 0.037035 1.597193 -1.274388
C 1.788453 -1.281269 -1.342301
C -3.728473 -0.724676 -1.631915
C -4.691798 -1.532704 0.464812
C -0.603450 3.530872 0.672729
C 4.058572 -0.687017 0.217812
C -0.207545 2.932728 -1.658343
C 3.081099 -1.564206 -1.836463
C -0.529261 3.908018 -0.685966
C 4.223503 -1.267786 -1.060238
H -0.954421 -1.055158 -1.201439
H -2.429761 0.366898 0.390375
H -2.443010 -1.049927 1.479303
H 0.147278 -3.117257 -0.267163
H -1.640599 -3.255415 -0.163204
H -0.678884 -2.871489 1.296181
H -0.433041 1.914014 2.113846
H 2.653926 0.045691 1.701824
H 0.316611 0.865285 -2.039516
H 0.922277 -1.536186 -1.961773
H -2.810597 -0.686956 -2.244415
H -4.105662 0.323829 -1.520655
H -4.483178 -1.304764 -2.192841
H -4.472058 -2.105834 1.382625
H -5.445058 -2.094678 -0.116967
H -5.151011 -0.557097 0.766158
H -0.846901 4.276356 1.437943
H 4.934703 -0.454786 0.833289
H -0.136821 3.214393 -2.715001
H 3.192979 -2.020598 -2.826405
H -0.712922 4.946311 -0.983375
H 5.225755 -1.489519 -1.442952


