%chk=000163897.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163897

0 1
 O  -0.9558000      -2.712100     -0.1519000    
 O   -4.966000     -0.2392000     -0.2407000    
 O   -3.385200       2.046800     -0.1370000    
 N    1.610700      -1.331200     -3.2499999E-02
 N  -0.7187000       2.064800     -4.2700000E-02
 C    2.752600      0.5779000      4.4199999E-02
 C    2.864100     -0.7958000      2.5500000E-02
 C    3.942300       1.472700      0.1211000    
 C    4.127300      -1.578600      3.3100002E-02
 C    5.235600      0.7106000     -0.2284000    
 C    5.298500     -0.6703000      0.4518000    
 C    1.365300      0.8911000      3.1999999E-03
 C   0.6677000     -0.3235000     -4.5899998E-02
 C  -0.7276000     -0.3656000     -9.5799997E-02
 C   0.6340000       2.084000      4.9999999E-03
 C   -1.353600      0.8717000     -9.1100000E-02
 C   -1.497000      -1.614200     -0.1489000    
 C   -2.822300      0.9586000     -0.1406000    
 C   -2.970400      -1.495700     -0.1977000    
 C   -3.588700     -0.3114000     -0.1943000    
 C   -5.513000     -0.2407000       1.063600    
 H    3.826800       2.327000     -0.5551000    
 H    4.019500       1.868000       1.141400    
 H    4.057400      -2.432700      0.7153000    
 H    4.311300      -1.970100     -0.9744000    
 H    5.295100      0.5730000      -1.315800    
 H    6.103300       1.311700      6.5700002E-02
 H    5.279400     -0.5293000       1.540300    
 H    6.246800      -1.163600      0.2106000    
 H    1.399200      -2.319100     -6.3600004E-02
 H    1.097600       3.062600      4.2599998E-02
 H   -3.535100      -2.421600     -0.2384000    
 H   -5.156500      0.6144000       1.648600    
 H   -5.287200      -1.175200       1.589100    
 H   -6.600600     -0.1587000      0.9771000    


%chk=000163897-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000163897

0 1
O -0.694488 -2.906187 -0.169216
O -4.924379 -0.818387 0.297905
O -3.573586 1.738639 0.577570
N 1.681383 -1.404812 -0.085018
N -0.773076 1.933649 0.463306
C 2.813964 0.579327 0.119018
C 2.951878 -0.805382 -0.065471
C 4.001254 1.511934 0.182035
C 4.249098 -1.546040 -0.225022
C 5.273573 0.804450 -0.360220
C 5.424156 -0.627835 0.211826
C 1.399738 0.846100 0.221792
C 0.721624 -0.423172 0.087216
C -0.682359 -0.518011 0.141709
C 0.580997 1.995019 0.407750
C -1.387807 0.704725 0.333651
C -1.376403 -1.826925 0.003567
C -2.881675 0.690736 0.404362
C -2.827665 -1.829333 0.070613
C -3.556691 -0.668279 0.256166
C -5.892278 0.290848 0.489273
H 3.805429 2.434279 -0.398491
H 4.175685 1.837352 1.228635
H 4.247965 -2.480967 0.369396
H 4.384316 -1.849378 -1.284241
H 5.219527 0.748508 -1.465859
H 6.167900 1.405010 -0.109758
H 5.456400 -0.576050 1.317887
H 6.379878 -1.072675 -0.121621
H 1.423825 -2.389867 -0.199712
H 1.019776 2.993764 0.517107
H -3.345155 -2.787592 -0.031102
H -5.808490 1.031976 -0.320310
H -5.731442 0.792385 1.455966
H -6.866076 -0.221510 0.462689


