%chk=000034936.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034936

0 1
 O   -1.669400       2.357000      1.6000000E-03
 O    1.669000       2.357400     -3.0000001E-04
 N   -2.337300      9.7900003E-02  1.0000000E-03
 N    2.336800      9.8200001E-02 -1.5000000E-03
 N  -9.9999997E-05  0.1338000      7.9999998E-04
 N    1.200000      -1.944100     -6.0000003E-04
 N   -1.199600      -1.944400      7.9999998E-04
 C   -1.122100     -0.6038000      1.1000000E-03
 C    1.122100     -0.6035000     -1.9999999E-04
 C   3.9999999E-04  -2.547300     -9.9999997E-05
 C   7.9999998E-04  -4.038000     -3.0000001E-04
 C   -2.528200       1.481100      1.3000000E-03
 C    2.528000       1.481600     -1.5000000E-03
 C   -3.993800       1.836700     -3.4000000E-03
 C    3.993500       1.837500      1.4000000E-03
 H   -3.163900     -0.4949000      1.9999999E-04
 H    3.163500     -0.4944000     -1.9000000E-03
 H   0.8748000      -4.426100      0.5321000    
 H  -0.8961000      -4.427900      0.4911000    
 H   2.4700001E-02  -4.407100      -1.029900    
 H   -4.483400       1.407100      0.8752000    
 H   -4.111500       2.923600      2.2000000E-02
 H   -4.465400       1.449300     -0.9110000    
 H    4.466100       1.450800      0.9087000    
 H    4.111000       2.924400     -2.4900001E-02
 H    4.482200       1.407300     -0.8775000    


%chk=000034936-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000034936

0 1
O -1.983943 2.490295 -0.004798
O 1.983351 2.490465 -0.010308
N -2.395876 0.156984 0.006098
N 2.395662 0.157224 0.003720
N -0.000131 0.306243 0.006935
N 1.205005 -1.821119 0.016059
N -1.205193 -1.821298 0.016871
C -1.137117 -0.445440 0.009384
C 1.136994 -0.445380 0.008470
C -0.000063 -2.466887 0.018869
C 0.000665 -3.970328 -0.001218
C -2.780404 1.527496 -0.001143
C 2.779984 1.527824 -0.004398
C -4.308482 1.684219 -0.006002
C 4.308012 1.684821 -0.002034
H -3.148688 -0.538682 0.009256
H 3.148616 -0.538285 0.007382
H 0.893957 -4.359466 0.512936
H -0.915451 -4.359458 0.470553
H 0.026614 -4.332517 -1.046361
H -4.766481 1.199926 0.877238
H -4.548392 2.756862 0.012511
H -4.753145 1.234935 -0.914242
H 4.753026 1.246466 0.911363
H 4.547752 2.757202 -0.033378
H 4.765830 1.190099 -0.879565


