%chk=000169753.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169753

0 1
 O   0.7364000     -0.5609000      -2.096600    
 O   -2.739500      -2.430700       1.738500    
 O   -4.840900      -1.411000      0.2358000    
 O    2.905900       2.207200       2.138200    
 N   0.3883000       2.179500     -0.9170000    
 N    3.621800      -1.540000     -9.1399997E-02
 C   0.2544000       1.149700      0.1376000    
 C   -1.103300      0.4468000      0.1488000    
 C   -2.188100      0.9849000     -0.5715000    
 C   -2.013200       2.230100      -1.401600    
 C  -0.7938000       3.038400     -0.9650000    
 C    1.444500      0.1993000      5.9099998E-02
 C   -1.319000     -0.6936000      0.9417000    
 C    2.355900      0.1373000       1.104300    
 C   -3.433900      0.3418000     -0.5463000    
 C    1.615000     -0.6029000      -1.060900    
 C   -2.566400      -1.318800      0.9703000    
 C   -3.620600     -0.8061000      0.2208000    
 C    2.711800      -1.449200      -1.087100    
 C    2.218900      0.9756000       2.327800    
 C    3.419500     -0.7423000      0.9812000    
 C    2.946300      -2.335200      -2.266700    
 H   0.2629000       1.722800       1.066100    
 H   -1.910700       1.933900      -2.453200    
 H   -2.903900       2.864000      -1.317300    
 H  -0.6198000       3.850400      -1.679500    
 H  -0.9619000       3.509700      1.1500000E-02
 H   0.4968000       1.727200      -1.825300    
 H  -0.5082000      -1.097400       1.543600    
 H   -4.264000      0.7445000      -1.122500    
 H    1.195400       1.148900       2.667600    
 H    2.703600      0.4706000       3.172400    
 H    4.169000     -0.8384000       1.760900    
 H    3.085000      -1.742300      -3.176400    
 H    3.852300      -2.935100      -2.126500    
 H    2.111900      -3.030900      -2.401900    
 H   0.9886000      -1.179500      -2.799300    
 H   -1.902200      -2.641400       2.186100    
 H   -4.790200      -2.187800      0.8196000    
 H    2.504500       2.659000       1.376400    


%chk=000169753-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169753

0 1
O 0.499576 -0.966039 -1.744841
O -3.096746 -2.725697 1.156429
O -4.988092 -1.400507 -0.253139
O 2.465768 2.807932 1.400493
N 0.455616 2.278259 -0.378984
N 3.805094 -1.455276 -0.127971
C 0.214432 1.008051 0.394325
C -1.155598 0.360619 0.155862
C -2.177480 1.038148 -0.559294
C -1.919599 2.409362 -1.176178
C -0.760484 3.135656 -0.458159
C 1.447341 0.124781 0.199268
C -1.436682 -0.890725 0.760026
C 2.598930 0.351414 1.011198
C -3.454606 0.436342 -0.690124
C 1.558493 -0.843229 -0.830313
C -2.702291 -1.475650 0.617892
C -3.723460 -0.816047 -0.116247
C 2.737342 -1.637978 -0.954620
C 2.637426 1.494005 2.020321
C 3.734672 -0.465357 0.808482
C 2.851862 -2.700770 -2.029538
H 0.217688 1.321161 1.460467
H -1.666234 2.301597 -2.251696
H -2.838819 3.023983 -1.130769
H -0.491157 4.072335 -0.977411
H -1.051211 3.398139 0.576265
H 0.798672 2.049900 -1.325999
H -0.649670 -1.409973 1.323684
H -4.259056 0.941886 -1.234623
H 1.872124 1.332097 2.815684
H 3.625347 1.509649 2.514662
H 4.634782 -0.320021 1.416168
H 2.833768 -2.268129 -3.050196
H 3.815071 -3.217617 -1.902890
H 2.047729 -3.461992 -1.963479
H 0.659275 -1.719399 -2.366987
H -2.379011 -3.138322 1.692983
H -4.990499 -2.268717 0.229665
H 1.738787 2.764229 0.671882


