%chk=000163486.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163486

0 1
 O   -4.039100     -0.8416000       1.063100    
 O   -3.683000       1.283700      -1.897400    
 O   -2.663900       1.751300       1.555200    
 N  -9.7999997E-02  0.8152000      6.7000002E-02
 C   -4.230500     -0.3271000     -0.2572000    
 C   -3.193000      -1.382200      2.7200000E-02
 C   -3.794100       1.089300     -0.4868000    
 C   -1.752800     -0.9602000      2.3600001E-02
 C   -2.451000       1.455300      0.1748000    
 C   -1.385800      0.3847000      6.7800000E-02
 C  -0.7027000      -1.876100     -3.2699998E-02
 C   0.6353000      -1.456700     -4.2100001E-02
 C   0.9129000     -7.7500001E-02  9.2000002E-03
 C    2.262400      0.3397000      9.9999997E-05
 C    1.674700      -2.392700     -0.1012000    
 C    3.310100     -0.6150000     -6.0500000E-02
 C    3.000400      -1.975600     -0.1104000    
 C    2.621000       1.703900      4.9400002E-02
 C    4.649600     -0.1916000     -6.9600001E-02
 C    3.957000       2.110200      3.9900001E-02
 C    4.970600       1.162900     -1.9600000E-02
 H   -5.138200     -0.6002000     -0.7775000    
 H   -3.425400      -2.389000     -0.3057000    
 H   -4.583800       1.760500     -0.1319000    
 H   -2.059800       2.367400     -0.2937000    
 H  -0.9365000      -2.939600     -7.1099997E-02
 H   -2.974300      0.7056000      -2.227800    
 H   -3.288900       2.494700       1.603000    
 H    1.460800      -3.458800     -0.1407000    
 H    3.786400      -2.726000     -0.1569000    
 H    1.857200       2.478300      9.6500002E-02
 H    5.459100     -0.9177000     -0.1157000    
 H    4.202100       3.167600      7.8800000E-02
 H    6.010200       1.476400     -2.7200000E-02


%chk=000163486-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000163486

0 1
O -4.044522 -0.897264 1.153046
O -3.906550 1.298294 -1.971270
O -2.714822 1.931797 1.457296
N -0.149250 0.826585 0.006716
C -4.284506 -0.340135 -0.219055
C -3.222294 -1.389822 -0.041458
C -3.864520 1.097796 -0.506083
C -1.792759 -0.990734 -0.043784
C -2.487037 1.500949 0.063660
C -1.433661 0.400096 -0.005034
C -0.758473 -1.936426 -0.086047
C 0.603006 -1.518983 -0.065535
C 0.870506 -0.101913 -0.012103
C 2.250410 0.370889 0.012937
C 1.702376 -2.454793 -0.094388
C 3.320374 -0.594397 -0.013749
C 3.010106 -2.006874 -0.067609
C 2.564438 1.761195 0.061379
C 4.672920 -0.134105 0.012289
C 3.899069 2.188355 0.085590
C 4.960675 1.235936 0.061827
H -5.246163 -0.627392 -0.664162
H -3.443979 -2.429149 -0.314652
H -4.608439 1.807087 -0.111458
H -2.117407 2.359261 -0.532882
H -0.991152 -3.008144 -0.122884
H -3.256174 0.683644 -2.401094
H -1.836442 2.195197 1.835956
H 1.479698 -3.527566 -0.134017
H 3.840783 -2.722140 -0.087112
H 1.735874 2.474780 0.076529
H 5.485092 -0.870388 -0.007258
H 4.131056 3.258220 0.122587
H 6.000767 1.579243 0.081722


