%chk=000144562.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000144562

0 1
 O   0.8529000      -3.002400      -1.016800    
 O    3.694900      0.1395000      1.8700000E-02
 O   -3.693500     -0.1413000      2.2900000E-02
 O  -0.8575000       3.001700      -1.017100    
 O    1.331100      -1.052800      -2.160100    
 O    2.925500       1.543800       1.683900    
 O   -2.920800      -1.542400       1.689200    
 O   -1.338100       1.051500      -2.158500    
 C  -0.2751000      -1.269100      0.9371000    
 C   0.2760000       1.271400      0.9336000    
 C    1.093500      -1.040300      0.2388000    
 C    1.381200      0.4869000      0.1607000    
 C   -1.379200     -0.4858000      0.1630000    
 C   -1.094500       1.039900      0.2397000    
 C  -0.1378000     -0.6537000       2.319600    
 C   0.1493000      0.6579000       2.317700    
 C    1.112800      -1.668400      -1.125400    
 C    2.738000      0.8020000      0.7290000    
 C   -2.735200     -0.8018000      0.7332000    
 C   -1.117400       1.667500      -1.124600    
 C   0.8403000      -3.728800      -2.249800    
 C    5.041400      0.3512000      0.4548000    
 C   -5.039400     -0.3539000      0.4608000    
 C  -0.8480000       3.727600      -2.250400    
 H  -0.5186000      -2.334000       1.021300    
 H   0.5194000       2.336500       1.015000    
 H    1.882600      -1.543800      0.8164000    
 H    1.405100      0.8710000     -0.8658000    
 H   -1.404200     -0.8715000     -0.8628000    
 H   -1.882300       1.543100      0.8194000    
 H  -0.2587000      -1.233700       3.224600    
 H   0.2771000       1.238800       3.221100    
 H   0.6228000      -4.776200      -2.025100    
 H    1.819400      -3.669100      -2.734500    
 H   5.7700001E-02  -3.341000      -2.909000    
 H    5.164000      5.2000000E-03   1.485500    
 H    5.305800       1.409300      0.3677000    
 H    5.703500     -0.2307000     -0.1919000    
 H   -5.161300     -6.5000001E-03   1.491200    
 H   -5.302700      -1.412500      0.3755000    
 H   -5.702900      0.2262000     -0.1861000    
 H  -0.6302000       4.775200      -2.026500    
 H   -1.828300       3.667600      -2.732600    
 H  -6.7000002E-02   3.339800      -2.911300    


%chk=000144562-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000144562

0 1
O 0.956507 -3.079409 -1.062925
O 3.718398 -0.114857 0.386956
O -3.716867 0.115014 0.393136
O -0.958849 3.078229 -1.063344
O 1.387152 -1.138241 -2.269051
O 3.081091 2.004777 1.094697
O -3.078592 -2.003865 1.102427
O -1.390462 1.136112 -2.267593
C -0.285942 -1.269278 0.918485
C 0.287989 1.269269 0.917164
C 1.098417 -1.046192 0.202349
C 1.386965 0.484383 0.124957
C -1.386111 -0.484943 0.127413
C -1.097467 1.045687 0.203359
C -0.156069 -0.661546 2.309123
C 0.160305 0.662492 2.308428
C 1.166884 -1.704251 -1.174574
C 2.776037 0.893032 0.605062
C -2.774505 -0.893196 0.609755
C -1.167992 1.702797 -1.173913
C 1.004534 -3.841925 -2.334927
C 5.117080 0.225824 0.744916
C -5.114852 -0.224616 0.754796
C -1.009901 3.840061 -2.335634
H -0.532870 -2.340719 0.942914
H 0.534977 2.340719 0.940495
H 1.861130 -1.552380 0.818864
H 1.349911 0.781442 -0.945799
H -1.350677 -0.782662 -0.943212
H -1.859225 1.552276 0.820730
H -0.300549 -1.266603 3.209272
H 0.306200 1.268164 3.207936
H 0.787460 -4.879953 -2.047378
H 2.004669 -3.754183 -2.791544
H 0.249656 -3.455445 -3.039852
H 5.187797 0.463654 1.819471
H 5.457491 1.095459 0.158443
H 5.696837 -0.673768 0.495851
H -5.183118 -0.461410 1.829737
H -5.457109 -1.094622 0.169950
H -5.694746 0.675042 0.506285
H -0.793448 4.878464 -2.048972
H -2.010723 3.751027 -2.790493
H -0.255817 3.454041 -3.041661


