%chk=000163791.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163791

0 1
 O   -1.355100       2.193700     -0.2033000    
 O    3.659600      0.6229000       1.378000    
 O    3.672700      -1.849800     -0.5421000    
 O   -3.055300       1.425700       1.159300    
 C   0.9730000       1.644700     -0.1125000    
 C    2.016200      0.5689000     -0.3169000    
 C    1.542700       1.396300      -1.486100    
 C  -0.4215000       1.231500      0.2811000    
 C  -0.8105000     -0.1459000     -0.2701000    
 C    1.577500     -0.8360000     -0.1738000    
 C   0.2766000      -1.189000     -0.1393000    
 C    1.403800       2.926600      0.5418000    
 C   -1.986700     -0.8024000      0.4547000    
 C   -1.861600      -2.296800      9.4599999E-02
 C  -0.3359000      -2.544000      0.1168000    
 C    3.378600      0.8246000      0.2039000    
 C    2.573900      -1.911300     -2.2600001E-02
 C   -2.586500      -3.173400       1.120800    
 C   -2.443300      -2.585000      -1.301700    
 C   -2.658200       1.977100      0.1417000    
 C   -3.560000       2.521800     -0.9241000    
 H    2.221000       2.129600      -1.910200    
 H   0.9144000      0.9356000      -2.240000    
 H  -0.4636000       1.221600       1.379500    
 H   -1.071400     -5.2000001E-02  -1.333500    
 H    2.380800       3.280900      0.1949000    
 H   0.6883000       3.729000      0.3317000    
 H    1.460100       2.801800       1.628700    
 H   -1.914700     -0.6725000       1.541900    
 H   -2.964700     -0.4785000      9.2799999E-02
 H  -3.1399999E-02  -3.275000     -0.6394000    
 H  -2.0199999E-02  -2.902600       1.103600    
 H    4.126700       1.193500     -0.5178000    
 H    2.255100      -2.805000      0.5367000    
 H   -3.661600      -2.962400       1.128900    
 H   -2.451800      -4.237000      0.8949000    
 H   -2.207600      -2.999600       2.134100    
 H   -1.936500      -2.018700      -2.089500    
 H   -2.343800      -3.647500      -1.552100    
 H   -3.508900      -2.333400      -1.343900    
 H   -3.364400       2.010900      -1.870300    
 H   -3.404000       3.598500      -1.027400    
 H   -4.602000       2.345500     -0.6422000    


%chk=000163791-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000163791

0 1
O -1.528093 2.008966 -0.517554
O 3.536885 1.086039 1.486255
O 3.918929 -1.564238 -0.077333
O -2.781768 2.102022 1.457364
C 0.862041 1.595944 -0.260444
C 1.989046 0.517626 -0.315774
C 1.491796 1.200671 -1.605907
C -0.525058 1.091218 0.130568
C -0.845347 -0.342299 -0.324685
C 1.602334 -0.917611 -0.056163
C 0.288385 -1.318222 -0.041741
C 1.188496 2.968517 0.323907
C -2.087061 -1.031428 0.296104
C -1.840248 -2.557021 0.060919
C -0.293222 -2.689389 0.284193
C 3.340915 0.934332 0.255593
C 2.702018 -1.881399 0.084761
C -2.642474 -3.430316 1.049947
C -2.203592 -2.954130 -1.395315
C -2.609145 2.441658 0.265621
C -3.507158 3.350170 -0.546299
H 2.152180 1.939331 -2.074740
H 0.923363 0.596317 -2.318745
H -0.654932 1.181049 1.226855
H -0.985893 -0.296473 -1.426405
H 2.147589 3.360077 -0.056826
H 0.396705 3.688974 0.051767
H 1.266782 2.922871 1.425419
H -2.133948 -0.811730 1.379916
H -3.035353 -0.689964 -0.153753
H 0.144111 -3.508245 -0.316867
H -0.089030 -2.931064 1.347398
H 4.130194 1.175426 -0.495816
H 2.423586 -2.933064 0.324413
H -3.730342 -3.297110 0.901659
H -2.414761 -4.504189 0.911068
H -2.409872 -3.164719 2.098101
H -1.616077 -2.387267 -2.141040
H -2.008640 -4.029418 -1.565815
H -3.275280 -2.769297 -1.595442
H -4.002712 2.771772 -1.346328
H -2.914670 4.142249 -1.033965
H -4.270880 3.796266 0.106732


