%chk=000122071.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122071

0 1
 O    4.595700       1.216600      0.6321000    
 O    2.393800      -2.880100     -1.2800000E-02
 O   -7.098400      0.8083000     -0.6953000    
 O   -7.278300      -1.286200      0.1690000    
 N    2.272000       1.224400      0.5053000    
 N    3.522800     -0.8404000      0.3103000    
 N  -0.1282000      -1.286100      5.1800001E-02
 N  -0.1647000      0.9252000      0.3325000    
 C    1.123500      0.4617000      0.3439000    
 C    1.174300     -0.8949000      0.1730000    
 C    2.175600       2.667700      0.6854000    
 C    3.539300      0.5895000      0.4935000    
 C    4.817600      -1.512900      0.2965000    
 C    2.376800      -1.662400      0.1417000    
 C    2.214200       3.421800     -0.6383000    
 C  -0.8965000     -0.1552000      0.1544000    
 C    5.410400      -1.602400      -1.104600    
 C   -2.336400     -0.2008000      7.0100002E-02
 C    2.135900       4.931200     -0.4580000    
 C    6.751300      -2.322000      -1.131200    
 C   -3.039500      0.8910000     -0.4385000    
 C   -3.024000      -1.336700      0.4968000    
 C   -4.431300      0.8471000     -0.5201000    
 C   -4.415800      -1.380600      0.4149000    
 C   -5.119500     -0.2887000     -9.3300000E-02
 C   -6.570500     -0.3351000     -0.1788000    
 H    3.013000       2.997000       1.312500    
 H    1.259300       2.903100       1.240300    
 H    4.702700      -2.522000      0.7099000    
 H    5.512000     -0.9814000      0.9577000    
 H  -0.4527000      -2.232500     -9.9200003E-02
 H    3.135400       3.174400      -1.179500    
 H    1.383200       3.095500      -1.275200    
 H    4.712800      -2.125300      -1.770100    
 H    5.537200     -0.5950000      -1.518900    
 H    2.976600       5.297200      0.1397000    
 H    2.165400       5.431800      -1.430700    
 H    1.206200       5.216300      4.4500001E-02
 H    6.651400      -3.348000     -0.7629000    
 H    7.140100      -2.363100      -2.153500    
 H    7.485700      -1.802300     -0.5078000    
 H   -2.521900       1.784500     -0.7792000    
 H   -2.507400      -2.199200      0.9101000    
 H   -4.939400       1.718700     -0.9229000    
 H   -4.933700      -2.273700      0.7550000    
 H   -8.077100      0.7670000     -0.7482000    


%chk=000122071-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122071

0 1
O 4.605233 1.249668 0.573630
O 2.531024 -2.978777 0.151267
O -7.278721 1.045021 -0.155583
O -7.429893 -1.269405 -0.294987
N 2.268617 1.201919 0.471020
N 3.559677 -0.849560 0.383770
N -0.127148 -1.390884 0.127887
N -0.184273 0.878641 0.291036
C 1.124071 0.432726 0.337311
C 1.195100 -0.967006 0.237812
C 2.192437 2.683159 0.543606
C 3.540053 0.576556 0.478353
C 4.904448 -1.490962 0.390148
C 2.424079 -1.716749 0.245899
C 2.233643 3.345043 -0.850987
C -0.939949 -0.259671 0.163221
C 5.525631 -1.565945 -1.022131
C -2.400238 -0.276594 0.073590
C 2.153174 4.882055 -0.740036
C 6.916450 -2.233021 -0.982230
C -3.099954 0.962883 0.100954
C -3.141433 -1.487795 -0.040104
C -4.501333 0.992622 0.015422
C -4.542781 -1.457904 -0.125467
C -5.234116 -0.218346 -0.098781
C -6.716682 -0.241343 -0.192695
H 3.048552 3.023355 1.150123
H 1.251286 2.935820 1.062490
H 4.770187 -2.505973 0.800720
H 5.551370 -0.898668 1.058286
H -0.410187 -2.365579 0.033339
H 3.171484 3.052052 -1.358865
H 1.390907 2.964881 -1.459032
H 4.850417 -2.140178 -1.684171
H 5.610102 -0.542312 -1.432219
H 3.000030 5.284716 -0.153567
H 2.183250 5.351585 -1.739246
H 1.215535 5.200254 -0.246558
H 6.854846 -3.262687 -0.582744
H 7.355861 -2.290179 -1.994055
H 7.614920 -1.660733 -0.343490
H -2.518415 1.884949 0.189251
H -2.635265 -2.460129 -0.061225
H -5.041470 1.942801 0.035478
H -5.123868 -2.381432 -0.212960
H -8.267761 0.964126 -0.221582


