%chk=000090019.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090019

0 1
 O    4.380400      0.6549000      -1.143300    
 O   -4.369500      0.6301000       1.154800    
 O    8.635600      -2.102900     -0.6296000    
 O   -8.629200      -2.116200      0.6170000    
 N   1.1000000E-03   1.591900     -1.9000000E-03
 N    3.499600      0.8348000      0.9984000    
 N   -3.511800      0.8519000     -0.9913000    
 C    1.156400      0.7628000      0.3127000    
 C   -1.157500      0.7692000     -0.3248000    
 C    2.354900       1.634700      0.6570000    
 C   -2.358700       1.648100     -0.6406000    
 C    5.550900     -0.3975000      0.6975000    
 C   -5.555100     -0.3828000     -0.6983000    
 C    6.597000     -0.8904000     -0.2975000    
 C   -6.593200     -0.8969000      0.2944000    
 C    4.430300      0.4051000      5.7900000E-02
 C   -4.429300      0.4060000     -5.0999999E-02
 C    7.701200      -1.705400      0.3653000    
 C   -7.703000      -1.697500     -0.3766000    
 H    1.405600      0.1162000     -0.5381000    
 H   0.9320000      0.1085000       1.164400    
 H  -0.9413000      0.1251000      -1.186600    
 H   -1.401900      0.1125000      0.5195000    
 H    2.136100       2.268900       1.523300    
 H    2.613700       2.288100     -0.1843000    
 H   -2.149900       2.299700      -1.496400    
 H   -2.610200       2.283300      0.2166000    
 H   0.2188000       2.205400     -0.7867000    
 H    5.100500      -1.254000       1.213700    
 H    6.030400      0.2340000       1.455200    
 H   -6.041200      0.2645000      -1.438400    
 H   -5.109500      -1.228400      -1.236300    
 H    3.622900      0.5726000       1.972100    
 H   -3.643200      0.6103000      -1.969300    
 H    7.042600     -3.8300000E-02 -0.8270000    
 H    6.118700      -1.496000      -1.078100    
 H   -7.034300     -5.6200001E-02  0.8456000    
 H   -6.108700      -1.519000       1.058100    
 H    7.292100      -2.602900      0.8398000    
 H    8.226300      -1.109900       1.118700    
 H   -7.297800      -2.584700     -0.8735000    
 H   -8.234100      -1.086000      -1.112900    
 H    9.326700      -2.619300     -0.1811000    
 H   -9.324100      -2.622900      0.1633000    


%chk=000090019-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000090019

0 1
O 4.511372 1.078329 -1.028192
O -4.196976 0.884680 1.065536
O 7.507357 -3.167111 -0.282593
O -7.386278 -3.234622 0.533065
N 0.042769 1.643748 -0.364887
N 3.506060 1.100789 1.067299
N -3.630189 1.154024 -1.172019
C 1.175300 0.860780 0.169041
C -1.196601 0.883431 -0.617795
C 2.308636 1.819465 0.604462
C -2.370215 1.857333 -0.878998
C 5.711718 0.003598 0.827368
C -5.752107 0.005666 -0.623601
C 6.041849 -1.278955 0.027196
C -5.957940 -1.339142 0.112985
C 4.536194 0.763606 0.201853
C -4.468702 0.707111 -0.161467
C 7.335241 -1.939260 0.511357
C -7.332297 -1.946799 -0.178413
H 1.595426 0.123467 -0.555905
H 0.812131 0.289804 1.045663
H -1.113248 0.162455 -1.469356
H -1.437007 0.294840 0.286191
H 1.939922 2.490235 1.400294
H 2.617944 2.436994 -0.258636
H -2.133415 2.527517 -1.727803
H -2.516832 2.474675 0.022910
H 0.327929 2.193650 -1.188166
H 5.514960 -0.238659 1.890733
H 6.588251 0.682204 0.803807
H -6.596726 0.683416 -0.384484
H -5.756599 -0.144110 -1.721722
H 3.552870 0.793386 2.039509
H -3.873103 0.950528 -2.142095
H 6.138107 -1.018980 -1.041450
H 5.215282 -2.009047 0.114440
H -5.851043 -1.172018 1.199041
H -5.177127 -2.063651 -0.185692
H 7.265293 -2.179429 1.596165
H 8.192578 -1.245522 0.362802
H -7.465485 -2.097398 -1.273385
H -8.132265 -1.260606 0.178727
H 8.354139 -3.611375 -0.025502
H -8.276874 -3.647647 0.403414


