%chk=000114918.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114918

0 1
 O   0.2878000      -2.364700     -1.2900000E-02
 O   -4.381600      -1.936300      5.1899999E-02
 O   -1.883800       2.631000      -1.226300    
 O    4.134400       2.130700      0.5991000    
 O   -1.839100       2.855100       1.049300    
 O    2.189600       2.528300     -0.5083000    
 N   0.4381000      0.4920000      3.3000000E-03
 N   -4.416700      0.7563000      6.8700001E-02
 C  -0.7199000     -9.8300003E-02  1.4000000E-02
 C  -0.8529000      -1.577000      6.8999999E-03
 C    1.582100     -0.3197000     -1.6100001E-02
 C    1.496900      -1.715100     -2.4100000E-02
 C   -1.980600      0.7096000      3.5500001E-02
 C   -3.198200      0.1330000      4.8400000E-02
 C    2.846400      0.2785000     -2.7600000E-02
 C   -2.055300      -2.150200      1.9500000E-02
 C   -3.296500      -1.359500      4.0700000E-02
 C    2.647600      -2.504800     -4.3299999E-02
 C    4.001000     -0.5065000     -4.6799999E-02
 C    3.901400      -1.897000     -5.4699998E-02
 C   -1.892700       2.185300      4.2700000E-02
 C    2.991900       1.729200     -1.9800000E-02
 H   -2.158100      -3.230600      1.4400000E-02
 H    2.574000      -3.588700     -5.0099999E-02
 H    4.993700     -6.4099997E-02 -7.0000000E-02
 H    4.800200      -2.506300     -7.2899997E-02
 H   -4.471500       1.766800      7.5000003E-02
 H   -5.266300      0.2055000      7.6300003E-02
 H   -1.826400       3.609200      -1.274500    
 H    4.225200       3.107500      0.6005000    


%chk=000114918-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000114918

0 1
O 0.237044 -2.316999 0.118161
O -4.521635 -2.008068 -0.131613
O -0.883025 2.807523 0.587221
O 4.227639 2.252934 0.081674
O -3.104902 2.886573 -0.000562
O 2.315178 2.484017 -1.217447
N 0.423706 0.520912 -0.084199
N -4.464202 0.651174 -0.122790
C -0.784375 -0.062651 0.012299
C -0.925233 -1.541464 0.038785
C 1.564553 -0.279644 -0.101759
C 1.495977 -1.697302 0.061374
C -2.011092 0.719640 0.050201
C -3.259584 0.043076 -0.051219
C 2.872320 0.304474 -0.209254
C -2.125516 -2.214106 0.005801
C -3.359553 -1.472652 -0.066190
C 2.627769 -2.521679 0.165324
C 4.015490 -0.515054 -0.085936
C 3.897513 -1.915365 0.100130
C -2.051118 2.188204 0.180108
C 3.043072 1.758348 -0.510402
H -2.164157 -3.305876 0.021656
H 2.502002 -3.600521 0.293938
H 5.002153 -0.048873 -0.143470
H 4.798352 -2.530530 0.184619
H -4.491217 1.681904 -0.146857
H -5.283079 0.033625 -0.168607
H -1.053770 3.789362 0.616149
H 4.330389 3.208218 -0.178337


