%chk=000135223.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135223

0 1
 O    4.968200      0.2192000      -1.268800    
 O   -4.843600     -0.7217000      -2.053200    
 O    6.063000      -2.082200     -0.4177000    
 C    1.947800     -1.1100000E-02 -4.2900000E-02
 C    1.114800       1.137100      0.5737000    
 C  -0.9267000     -0.3690000      0.2088000    
 C    3.351500      0.3899000      0.4707000    
 C   -2.454600     -0.4017000      0.6208000    
 C    1.443300      -1.371200      0.4963000    
 C  -0.3415000       1.042700      0.2135000    
 C  -1.8500000E-02  -1.341400      0.9986000    
 C    1.928800       2.389700      0.2441000    
 C    3.390800       1.924900      0.3426000    
 C    1.906700     -2.4100000E-02  -1.595300    
 C   -3.193200      0.7968000     -5.0000002E-04
 C   -3.058500      -1.738900      0.1018000    
 C   -1.126000       2.088900     -8.6300001E-02
 C   -2.626600     -0.3151000       2.154300    
 C    4.484600     -0.2723000     -0.2501000    
 C   -4.697100      0.7210000     -0.1392000    
 C   -4.586800      -1.786200      0.1106000    
 C   -2.532200       1.915600     -0.3540000    
 C   -5.185400     -0.6221000     -0.6726000    
 C    4.991200      -1.568900      0.3449000    
 H    1.150400       1.036800       1.671500    
 H  -0.8787000     -0.6986000     -0.8396000    
 H    3.446800      0.1524000       1.539400    
 H    2.068100      -1.715300       1.329500    
 H    1.535300      -2.143200     -0.2780000    
 H  -0.4156000      -2.361600      0.9622000    
 H  -2.4000001E-03  -1.054700       2.057900    
 H    1.722200       3.207100      0.9433000    
 H    1.716900       2.759600     -0.7656000    
 H    3.953800       2.287500     -0.5237000    
 H    3.868200       2.358300       1.229600    
 H    2.499300     -0.8546000      -1.996100    
 H   0.8933000     -0.1501000      -1.984500    
 H    2.303700      0.8971000      -2.033500    
 H   -2.683900      -2.581100      0.6962000    
 H   -2.722400      -1.922900     -0.9276000    
 H  -0.7443000       3.103800     -0.1010000    
 H   -3.679300     -0.2284000       2.445700    
 H   -2.235200      -1.207800       2.653900    
 H   -2.104700      0.5548000       2.569200    
 H   -5.138700      0.8912000      0.8508000    
 H   -5.059400       1.525200     -0.7920000    
 H   -4.905000      -2.733700     -0.3407000    
 H   -4.958400      -1.776200       1.141500    
 H   -3.057100       2.771200     -0.7673000    
 H   -6.278400     -0.6698000     -0.6072000    
 H    4.189100      -2.309600      0.3391000    
 H    5.332300      -1.400200       1.370000    
 H   -5.274400      1.6000001E-02  -2.517700    
 H    6.803300      -1.456400     -0.3401000    


%chk=000135223-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000135223

0 1
O 5.086095 0.246241 -1.221459
O -4.690711 -1.101918 -2.088096
O 6.037980 -2.178437 -0.627354
C 1.956218 -0.006653 0.003251
C 1.115549 1.131309 0.687649
C -0.944359 -0.345786 0.229962
C 3.396420 0.381625 0.554200
C -2.461666 -0.363944 0.641176
C 1.416243 -1.401050 0.462267
C -0.332566 1.061543 0.271386
C -0.047321 -1.345879 1.005610
C 1.934158 2.418656 0.453356
C 3.425092 1.945787 0.518213
C 1.915637 0.110631 -1.543478
C -3.190119 0.768743 -0.118756
C -3.056603 -1.757612 0.252614
C -1.104877 2.118387 -0.122298
C -2.656037 -0.097011 2.167222
C 4.532127 -0.270929 -0.206396
C -4.693940 0.659935 -0.302298
C -4.599057 -1.812412 0.211443
C -2.518305 1.914216 -0.458992
C -5.168420 -0.745362 -0.735746
C 5.032229 -1.641937 0.261748
H 1.160754 0.911673 1.781142
H -0.941086 -0.657234 -0.843046
H 3.432957 0.024186 1.604140
H 2.061547 -1.824050 1.258329
H 1.463763 -2.107841 -0.388495
H -0.477151 -2.363042 0.960492
H -0.027316 -1.059840 2.074812
H 1.710588 3.196108 1.205092
H 1.702042 2.846049 -0.539192
H 3.995512 2.284941 -0.363338
H 3.940614 2.338380 1.412711
H 2.476266 -0.717704 -2.013741
H 0.875690 0.063522 -1.909639
H 2.363522 1.051762 -1.905092
H -2.686720 -2.523710 0.960689
H -2.688162 -2.027844 -0.755043
H -0.690010 3.131799 -0.176691
H -3.728273 -0.023111 2.423526
H -2.225375 -0.913191 2.776029
H -2.171469 0.852034 2.459885
H -5.206676 0.883422 0.659336
H -5.043013 1.430762 -1.018997
H -4.925713 -2.810541 -0.134167
H -5.033017 -1.656424 1.218345
H -3.065245 2.737539 -0.938847
H -6.280004 -0.775065 -0.719571
H 4.176018 -2.344343 0.330642
H 5.446541 -1.524151 1.287490
H -4.864085 -0.344409 -2.701940
H 6.208534 -1.471119 -1.314785


