%chk=000128272.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128272

0 1
 O    3.162900     -0.4112000     -0.1256000    
 O   -3.155500     -0.4027000      0.1546000    
 O    2.273700     -0.6394000      -2.250900    
 O   -2.357000     -0.4273000       2.327400    
 O    6.332100      -2.041600      0.3191000    
 O   -6.304600      -2.077400     -0.2676000    
 O    5.085600     -0.8024000       1.767700    
 O   -4.997100     -0.9760000      -1.772700    
 N  -7.6000001E-03   2.578800     -8.2400002E-02
 C  -2.2000000E-03 -0.2376000      5.5700000E-02
 C    1.131000      0.5617000     -0.5571000    
 C   -1.142800      0.6130000      0.5778000    
 C    1.092300       1.911900     -0.6012000    
 C   -1.105800       1.961400      0.4967000    
 C    2.161500       2.808000      -1.164700    
 C   -2.165400       2.903700      0.9989000    
 C    2.239800     -0.2331000      -1.102500    
 C   -2.274300     -0.1306000       1.148400    
 C    4.313600      -1.172700     -0.5061000    
 C   -4.321900      -1.128600      0.5564000    
 C    5.252200      -1.294900      0.6619000    
 C   -5.210600      -1.362900     -0.6336000    
 H  -0.3937000     -0.9296000     -0.7007000    
 H   0.3957000     -0.8390000      0.8829000    
 H  -6.3000000E-03   3.591800     -0.1253000    
 H    2.537500       3.483800     -0.3892000    
 H    1.756800       3.411900      -1.983900    
 H    3.015800       2.249000      -1.557600    
 H   -2.560000       3.504700      0.1727000    
 H   -1.745500       3.581200       1.750100    
 H   -3.009200       2.382500       1.460400    
 H    3.997700      -2.176900     -0.8081000    
 H    4.834600     -0.6589000      -1.321000    
 H   -4.019900      -2.099100      0.9644000    
 H   -4.876300     -0.5422000       1.296700    
 H    6.962200      -2.138000       1.064800    
 H   -6.902800      -2.245500      -1.026800    


%chk=000128272-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000128272

0 1
O 3.389983 -0.294899 0.368883
O -2.957337 -1.050768 0.435014
O 1.843052 -1.937956 -0.263761
O -3.875736 1.065852 0.828289
O 6.376950 -1.446189 -1.389204
O -6.206781 -2.110713 -0.899784
O 4.920566 0.298003 -1.898644
O -4.524033 -0.867584 -1.927106
N 0.197947 2.516953 0.420442
C -0.392190 -0.278902 0.197484
C 1.034467 0.282344 0.214589
C -1.457230 0.782544 0.470641
C 1.286634 1.641322 0.281763
C -1.141165 2.126843 0.551546
C 2.627461 2.342292 0.209188
C -2.115404 3.263639 0.768811
C 2.065467 -0.741197 0.062518
C -2.852244 0.363330 0.596996
C 4.465292 -1.217259 0.019412
C -4.318218 -1.574078 0.451251
C 5.229106 -0.673187 -1.181123
C -4.970262 -1.449499 -0.923044
H -0.589674 -0.773263 -0.773844
H -0.475788 -1.096945 0.936653
H 0.401358 3.516621 0.448020
H 3.186530 2.223225 1.153361
H 2.491702 3.422849 0.014968
H 3.260041 1.913132 -0.583278
H -1.601897 4.241870 0.724125
H -2.622088 3.169561 1.744143
H -2.920063 3.242143 0.016013
H 5.142751 -1.304252 0.884565
H 4.052783 -2.216440 -0.221462
H -4.240616 -2.635800 0.732428
H -4.946457 -1.034764 1.183846
H 6.868839 -1.109146 -2.186127
H -6.647250 -2.023883 -1.787972


