%chk=000089401.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089401

0 1
 O  -0.2826000      0.5076000      0.2677000    
 O   -4.175500      0.1927000      -2.214900    
 O    5.748000     -0.8146000     -0.7504000    
 O   -5.556500      -1.322800       1.060100    
 O   -4.034900      -2.248100     -0.3472000    
 O   -1.844200       1.922700       1.181000    
 N   -2.459100     -6.9999998E-04  3.8300000E-02
 C   -3.890100      0.1272000      0.1673000    
 C    2.088500      0.7826000      0.3490000    
 C   -4.495200      0.8775000      -1.010000    
 C   0.7626000       1.361100      0.7470000    
 C    2.733700     -0.1084000       1.199200    
 C    2.659400       1.142700     -0.8663000    
 C   -4.461900      -1.272400      0.2564000    
 C   -1.557400      0.9072000      0.5556000    
 C    4.545500     -0.2897000     -0.3887000    
 C    3.966300     -0.6464000      0.8292000    
 C    3.891900      0.6047000      -1.236400    
 C    6.361500      -1.722800      0.1632000    
 H   -4.103200      0.6584000       1.102000    
 H   -4.091600       1.893200      -1.075700    
 H   -5.585300      0.9316000     -0.9231000    
 H   0.6987000       1.446900       1.839000    
 H   0.6441000       2.365600      0.3219000    
 H   -2.085400     -0.7924000     -0.4775000    
 H    2.289500     -0.3939000       2.148900    
 H    2.158000       1.836800      -1.535100    
 H    4.418600      -1.335400       1.534300    
 H    4.337800      0.8857000      -2.186600    
 H   -4.575300      0.6970000      -2.943900    
 H   -5.939300      -2.225200       1.099800    
 H    6.604600      -1.235100       1.113300    
 H    5.755100      -2.624200      0.3025000    
 H    7.308900      -2.040900     -0.2844000    


%chk=000089401-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000089401

0 1
O -0.544483 0.319390 1.921227
O -2.996016 -1.405825 -1.815591
O 4.927067 -0.320238 -1.468089
O -5.850493 -0.194998 -0.609026
O -4.811342 -1.429349 1.064750
O -1.262644 1.926277 0.339179
N -2.470756 -0.030905 0.766880
C -3.533226 0.286462 -0.181261
C 1.823227 0.732340 1.224180
C -3.134052 0.045736 -1.656816
C 0.703286 1.132072 2.155049
C 2.743954 -0.277072 1.591491
C 1.976121 1.362417 -0.042231
C -4.759594 -0.549344 0.181699
C -1.416635 0.828550 0.948718
C 3.927745 -0.026801 -0.527966
C 3.794343 -0.665826 0.730323
C 3.015161 0.989577 -0.911738
C 5.896317 -1.363891 -1.125438
H -3.799039 1.357686 -0.095155
H -2.184614 0.583258 -1.844746
H -3.931349 0.445147 -2.314298
H 0.940742 0.906044 3.206489
H 0.434872 2.196141 2.039184
H -2.520093 -0.912725 1.282041
H 2.639856 -0.773253 2.564306
H 1.260627 2.136796 -0.339796
H 4.490760 -1.448683 1.044863
H 3.144903 1.468355 -1.887110
H -2.487261 -1.612739 -2.636611
H -6.626546 -0.775962 -0.385598
H 6.477201 -1.093837 -0.221958
H 5.398034 -2.340337 -0.968223
H 6.569127 -1.426266 -1.993229


