%chk=000125598.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125598

0 1
 O    1.257400     -0.8416000      -1.190400    
 O    1.463100      0.9736000      0.2461000    
 O  -0.2961000      -2.354300       2.185400    
 O   -1.882600       2.065000     -0.8009000    
 O    3.867100      -1.534600     -0.6468000    
 O    4.095800      0.7063000     -0.2977000    
 O   -1.264800       4.152400      0.9539000    
 O   -3.062100      -2.119000      -1.367300    
 N   -2.101400     -0.8243000      0.3124000    
 C  -6.1200000E-02 -0.3007000     -0.9882000    
 C  -0.7255000      -1.191600      8.4500000E-02
 C   0.3182000       1.129600     -0.6110000    
 C    1.939900     -0.3460000     -3.5399999E-02
 C   7.8400001E-02  -1.225100       1.401300    
 C    1.592200      -1.261600       1.135500    
 C  -0.7395000       1.985200      5.3199999E-02
 C    3.403900     -0.3005000     -0.3311000    
 C  -0.2406000       3.404900      0.3065000    
 C   -3.155300      -1.322400     -0.4371000    
 C   -4.486800     -0.7954000      2.6799999E-02
 H  -0.6212000     -0.3368000      -1.928700    
 H  -0.7337000      -2.218800     -0.3074000    
 H   0.6790000       1.632300      -1.519700    
 H  -0.1547000     -0.3369000       2.000600    
 H    2.123800     -0.9609000       2.046800    
 H    1.894500      -2.295800      0.9255000    
 H   -1.057900       1.565200       1.011100    
 H   -2.307100     -0.1654000       1.057300    
 H   0.6515000       3.421700      0.9398000    
 H  -1.5400000E-02   3.916600     -0.6346000    
 H   0.2401000      -2.338100       2.996500    
 H   -2.544000       2.618300     -0.3511000    
 H    4.827700      -1.525900     -0.8452000    
 H   -1.450100       3.719500       1.804700    
 H   -5.259500      -1.052900     -0.7027000    
 H   -4.739500      -1.242000      0.9923000    
 H   -4.449000      0.2932000      0.1270000    


%chk=000125598-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125598

0 1
O 1.233714 -0.891577 -1.267702
O 1.441455 0.952484 0.192562
O -0.362059 -2.287753 2.282991
O -1.960986 2.121926 -0.769226
O 4.112424 -1.494676 -0.195114
O 3.988743 0.666313 -1.048707
O -1.298233 4.254694 0.866752
O -2.885783 -1.312283 -1.719749
N -2.130695 -0.997614 0.455186
C -0.146023 -0.368559 -0.995693
C -0.725453 -1.283147 0.127405
C 0.203575 1.095412 -0.652774
C 1.966391 -0.404456 -0.084084
C 0.127878 -1.201764 1.412406
C 1.640803 -1.320676 1.111467
C -0.798673 1.967477 0.108982
C 3.443807 -0.304554 -0.499558
C -0.206710 3.358457 0.420647
C -3.134548 -1.064712 -0.500119
C -4.544445 -0.784486 0.005552
H -0.734153 -0.477007 -1.915679
H -0.639399 -2.313108 -0.275768
H 0.478076 1.610313 -1.593166
H -0.050967 -0.227106 1.911963
H 2.232028 -1.023073 1.997851
H 1.904857 -2.358837 0.848113
H -1.106353 1.476418 1.057649
H -2.383053 -1.024153 1.445456
H 0.609239 3.291785 1.163136
H 0.174447 3.825508 -0.502500
H 0.181624 -2.313836 3.110639
H -2.385161 2.987015 -0.512916
H 5.050273 -1.442510 -0.525294
H -1.491264 4.092147 1.824375
H -5.243146 -1.502690 -0.453148
H -4.637589 -0.835633 1.104749
H -4.840044 0.227459 -0.324784


