%chk=000072250.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072250

0 1
 O    1.304200     -0.3239000     -0.9795000    
 O    3.623000       1.317000      0.1619000    
 O    1.842800      -3.046500     -0.5908000    
 O   -1.267800       2.842500     -0.3682000    
 O   -4.664600     -0.2039000      0.2061000    
 N  -0.6970000      0.5866000     -0.1788000    
 N   -2.952000       1.312400     -8.0700003E-02
 C    2.773000      0.3401000      0.7591000    
 C    1.415300      0.9451000       1.031900    
 C   0.7148000      0.7992000     -0.3091000    
 C    2.464000     -0.7613000     -0.2453000    
 C    2.125000      -2.090000      0.4178000    
 C   -1.158100     -0.7126000     -9.1000004E-03
 C   -1.605300       1.666000     -0.2205000    
 C   -2.447400      -1.047500      0.1245000    
 C    4.918500      0.7942000     -0.1156000    
 C   -3.465700      3.5799999E-02  9.0200000E-02
 C   -2.922500      -2.453200      0.3063000    
 H    3.243600     -2.1299999E-02   1.680200    
 H   0.9018000      0.3683000       1.810700    
 H    1.451800       1.990400       1.354500    
 H   0.9014000       1.683400     -0.9302000    
 H    3.240200     -0.9347000     -0.9934000    
 H    1.271600      -2.026100       1.096500    
 H    2.985900      -2.449900      0.9912000    
 H  -0.4279000      -1.505000      7.6000001E-03
 H    4.932600      0.2629000      -1.070200    
 H    5.282600      0.1513000      0.6920000    
 H    5.603700       1.642000     -0.2091000    
 H   -3.624800       2.073600     -0.1079000    
 H    1.644400      -3.885900     -0.1418000    
 H   -3.461600      -2.555100       1.253800    
 H   -2.092900      -3.168200      0.3176000    
 H   -3.595200      -2.737900     -0.5093000    


%chk=000072250-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000072250

0 1
O 1.367606 -0.303105 -1.123133
O 3.823242 1.283400 -0.133839
O 1.397418 -2.989649 -0.102580
O -1.122135 2.695318 0.411715
O -4.634639 -0.385304 0.766900
N -0.712566 0.453858 -0.158108
N -2.850325 1.110829 0.579451
C 2.847919 0.469499 0.595288
C 1.550702 1.302694 0.682930
C 0.701120 0.846271 -0.536523
C 2.413857 -0.794697 -0.191510
C 1.904327 -1.901524 0.743088
C -1.193060 -0.845428 -0.339253
C -1.538309 1.506183 0.286550
C -2.490313 -1.210717 -0.050169
C 5.171905 0.714779 -0.149737
C -3.421596 -0.193760 0.456175
C -3.010197 -2.613780 -0.247644
H 3.254255 0.210364 1.598568
H 1.012776 1.116764 1.626821
H 1.785044 2.374908 0.628190
H 0.619805 1.629814 -1.306691
H 3.205127 -1.203457 -0.841463
H 1.106418 -1.517302 1.413857
H 2.756577 -2.245860 1.368281
H -0.457660 -1.552249 -0.736172
H 5.223135 -0.233712 -0.723121
H 5.544250 0.534524 0.881592
H 5.808159 1.465496 -0.642792
H -3.475185 1.853035 0.910361
H 1.146040 -3.760264 0.466049
H -3.390754 -3.031329 0.702649
H -2.222784 -3.278372 -0.642453
H -3.862759 -2.619428 -0.950877


