%chk=000169715.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169715

0 1
 O   -2.936000      -1.835800     -0.1313000    
 O   -4.065600      0.5373000      -1.303200    
 O    2.996300       2.402400     -2.8500000E-02
 N  -0.3344000     -0.9321000      4.9800001E-02
 N   0.3121000       1.725800      0.1015000    
 N    2.041300      -1.458100      3.5000001E-03
 N    3.704900      0.2173000     -4.3499999E-02
 N    4.257700      -2.069000     -5.9200000E-02
 C   -1.423700      1.2900000E-02 -0.1904000    
 C   -2.718800     -0.5306000      0.3976000    
 C   -1.068900       1.388100      0.4103000    
 C   -3.922600      0.3735000      0.1063000    
 C    1.002200     -0.5580000      3.3199999E-02
 C    1.294800      0.7621000      3.7500001E-02
 C   -5.221100     -0.1970000      0.6647000    
 C    2.731000       1.202900     -1.5300000E-02
 C    3.350700      -1.041600     -3.3100002E-02
 H   -1.504900      0.1041000      -1.281100    
 H   -2.613100     -0.6522000       1.482700    
 H   -1.722100       2.171100      1.3000000E-02
 H   -1.185400       1.375800       1.500800    
 H  -0.5214000      -1.927500     -1.5100000E-02
 H   -3.781400       1.365900      0.5479000    
 H   0.6048000       2.696200      0.1391000    
 H   -5.478700      -1.147700      0.1858000    
 H   -6.052300      0.4866000      0.4599000    
 H   -5.155900     -0.3507000       1.746000    
 H    1.797300      -2.442000      2.9000000E-03
 H   -3.076800      -1.746800      -1.089500    
 H   -3.386800       1.166400      -1.600100    
 H    3.959600      -3.038300     -5.1700000E-02
 H    5.255200      -1.888000     -8.8100001E-02


%chk=000169715-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169715

0 1
O -2.826045 -1.872777 -0.049484
O -4.247304 -0.129314 -1.512348
O 3.107471 2.440501 0.294375
N -0.349937 -0.879583 -0.087871
N 0.374796 1.822428 0.202859
N 1.992662 -1.483837 -0.122013
N 3.733939 0.172126 0.029777
N 4.285752 -2.096589 -0.176214
C -1.392171 0.151334 -0.162588
C -2.711261 -0.465852 0.375394
C -0.946137 1.404929 0.660683
C -3.975139 0.299373 -0.108001
C 0.986901 -0.504517 -0.018953
C 1.364339 0.825100 0.109087
C -5.225413 -0.052826 0.698146
C 2.777659 1.213220 0.149092
C 3.335908 -1.087521 -0.087784
H -1.531091 0.481146 -1.219162
H -2.676458 -0.493654 1.479780
H -1.665842 2.230925 0.511794
H -0.963429 1.121147 1.740063
H -0.689521 -1.845095 -0.070491
H -3.790936 1.392563 -0.080420
H 0.743760 2.754172 0.414146
H -5.380061 -1.145605 0.707184
H -6.114278 0.425315 0.254736
H -5.120763 0.292005 1.742559
H 1.731589 -2.465930 -0.218800
H -3.330807 -1.842302 -0.913260
H -3.677539 0.386575 -2.138182
H 4.060915 -3.078580 -0.304483
H 5.256441 -1.795876 -0.147223


