%chk=000131963.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131963

1 1
 O   0.1853000     -0.7038000     -0.2221000    
 N    3.799800     -0.3697000     -0.1700000    
 N    2.385700       1.347200     -1.3300000E-02
 N   -6.010800      0.2881000      0.2192000    
 N   -6.193100       1.031700     -0.7695000    
 N   -6.366100       1.710900      -1.670300    
 C    2.518800     -2.4800001E-02 -0.1439000    
 C    4.552700      0.7795000     -5.5799998E-02
 C    3.677600       1.852900      4.2399999E-02
 C    1.520100      -1.003900     -0.2430000    
 C    4.264200      -1.766500     -0.3013000    
 C    1.164100       2.114600      5.3700000E-02
 C    6.015500      0.7097000     -5.5900000E-02
 C    3.950100       3.297600      0.1811000    
 C    1.924100      -2.343000     -0.3690000    
 C    3.267500      -2.724700     -0.3985000    
 C  -0.5871000      -1.284900      0.8230000    
 C   -2.019900     -0.8691000      0.6624000    
 C   -2.881500      -1.648300     -0.1014000    
 C   -2.472800      0.2910000       1.280400    
 C   -4.213700      -1.262000     -0.2490000    
 C   -3.805000      0.6770000       1.132800    
 C   -4.675500     -9.9399999E-02  0.3681000    
 H    5.315300      -2.025300     -0.3217000    
 H    1.374900       3.184100      8.6000003E-02
 H   0.5692000       1.896100     -0.8367000    
 H   0.6271000       1.822900      0.9595000    
 H    6.470400       1.700100      3.7599999E-02
 H    6.384100      0.2680000     -0.9873000    
 H    6.376200      0.1041000      0.7816000    
 H    3.498700       3.694500       1.096300    
 H    3.554600       3.852800     -0.6757000    
 H    5.023600       3.502400      0.2341000    
 H    1.174900      -3.126600     -0.4693000    
 H    3.530300      -3.773200     -0.5024000    
 H  -0.2022000     -0.9518000       1.795700    
 H  -0.5257000      -2.379700      0.8063000    
 H   -2.531800      -2.554600     -0.5880000    
 H   -1.803000      0.9041000       1.877000    
 H   -4.884100      -1.874100     -0.8468000    
 H   -4.154900       1.584500       1.618000    


%chk=000131963-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000131963

1 1
O 0.282743 -0.691847 0.289474
N 3.933436 -0.376033 0.056168
N 2.449693 1.288867 -0.101665
N -5.872062 0.974744 0.538420
N -6.603174 1.141218 -0.487234
N -7.424063 1.402589 -1.298963
C 2.568906 -0.073518 0.084135
C 4.673164 0.815987 -0.150030
C 3.741225 1.847685 -0.246742
C 1.599840 -1.107101 0.280378
C 4.403510 -1.677858 0.215089
C 1.177508 2.045339 -0.135284
C 6.166306 0.813878 -0.227873
C 3.969839 3.310371 -0.465437
C 2.075332 -2.421776 0.441396
C 3.476795 -2.691837 0.406209
C -0.796255 -1.745699 0.503692
C -2.122327 -1.046299 0.484143
C -2.851511 -0.913494 -0.725731
C -2.670024 -0.504527 1.677539
C -4.093324 -0.252561 -0.755403
C -3.907866 0.159745 1.666416
C -4.624633 0.289847 0.447542
H 5.482194 -1.825563 0.180076
H 1.401861 3.102255 -0.334409
H 0.521410 1.654978 -0.927033
H 0.653373 1.957657 0.828387
H 6.543856 1.833862 -0.395976
H 6.534229 0.185979 -1.061018
H 6.627233 0.442724 0.706801
H 3.575697 3.918628 0.368935
H 3.495546 3.666360 -1.398186
H 5.047508 3.519312 -0.544355
H 1.379414 -3.248847 0.594144
H 3.835507 -3.715745 0.531815
H -0.589220 -2.227478 1.477521
H -0.697228 -2.484248 -0.313483
H -2.449063 -1.336707 -1.653866
H -2.127119 -0.609737 2.624096
H -4.648354 -0.166059 -1.696165
H -4.342299 0.573312 2.580780


