%chk=000000860.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000860

0 1
 O   -6.337100       1.443300     -0.1903000    
 O   -6.236500     -0.5820000      0.8362000    
 C   -1.451800      -2.414600      1.9000000E-03
 C   2.6500000E-02  -2.485500     -0.3928000    
 C   -2.113100      -1.085400     -0.3720000    
 C   0.7087000      -3.785400      4.9600001E-02
 C   -3.566500      -1.035900      0.1106000    
 C    2.206800      -3.814100     -0.2830000    
 C   -4.264500      0.2658000     -0.2719000    
 C    3.090300      -2.749600      0.3112000    
 C   -5.700300      0.3073000      0.1878000    
 C    3.875800      -1.882100     -0.3453000    
 C    4.726400     -0.8496000      0.3370000    
 C    4.412600      0.5326000     -0.1569000    
 C    4.045400       1.545200      0.6431000    
 C    3.739900       2.929300      0.1497000    
 C    2.314300       3.310100      0.4242000    
 C    1.425300       3.614500     -0.5331000    
 C  -2.7000001E-03   3.982200     -0.2582000    
 C  -0.8996000       2.754000     -0.2479000    
 H   -1.992900      -3.239500     -0.4776000    
 H   -1.537800      -2.565900       1.085200    
 H   0.1172000      -2.379900      -1.480800    
 H   0.5450000      -1.628400      5.3399999E-02
 H   -2.076900     -0.9504000      -1.459400    
 H   -1.552400     -0.2585000      7.7799998E-02
 H   0.5805000      -3.912100       1.131700    
 H   0.2175000      -4.638900     -0.4329000    
 H   -3.593500      -1.159500       1.200800    
 H   -4.119400      -1.884200     -0.3127000    
 H    2.314900      -3.803200      -1.375600    
 H    2.602700      -4.783600      4.5800000E-02
 H   -3.740000       1.113700      0.1815000    
 H   -4.253900      0.3832000      -1.361100    
 H    3.069700      -2.700100       1.398700    
 H    3.918800      -1.928400      -1.431000    
 H    4.619800     -0.9100000       1.426900    
 H    5.777600      -1.065800      0.1121000    
 H    4.510300      0.7097000      -1.225800    
 H    3.963500       1.374600       1.714200    
 H    4.396900       3.637500      0.6683000    
 H    3.968700       3.021300     -0.9192000    
 H   -7.268700       1.460200      0.1163000    
 H    2.004100       3.347400       1.466100    
 H    1.726100       3.572800      -1.576900    
 H  -0.3433000       4.688800      -1.023400    
 H  -8.5000001E-02   4.500200      0.7047000    
 H  -0.8562000       2.221700      -1.204100    
 H   -1.939100       3.048300     -7.1800001E-02
 H  -0.6077000       2.057200      0.5450000    


%chk=000000860-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000000860

0 1
O -6.125703 1.586489 -0.807250
O -6.186047 -0.164933 0.714253
C -1.333033 -2.419828 0.171206
C 0.120389 -2.614845 -0.315333
C -2.031721 -1.209095 -0.487292
C 0.819603 -3.832949 0.327480
C -3.472202 -0.988786 0.024353
C 2.297896 -4.005860 -0.124530
C -4.145076 0.224071 -0.645833
C 3.202364 -2.894018 0.368293
C -5.554998 0.478441 -0.152287
C 3.912643 -2.046420 -0.420022
C 4.807000 -0.925022 0.086157
C 4.356074 0.442165 -0.407080
C 4.051401 1.495888 0.392534
C 3.604534 2.864695 -0.098741
C 2.281407 3.301215 0.511816
C 1.168342 3.636028 -0.190710
C -0.151515 4.066560 0.417701
C -1.320118 3.124064 0.028414
H -1.920289 -3.339710 -0.032986
H -1.335517 -2.288473 1.273568
H 0.125668 -2.735243 -1.419522
H 0.707810 -1.699707 -0.101091
H -2.044866 -1.351090 -1.588575
H -1.427729 -0.296136 -0.300146
H 0.786183 -3.735667 1.432883
H 0.255730 -4.755098 0.077899
H -3.463739 -0.844023 1.121742
H -4.080225 -1.895572 -0.158795
H 2.341650 -4.061611 -1.230609
H 2.670580 -4.978472 0.259819
H -3.555726 1.147292 -0.477968
H -4.189377 0.098528 -1.745833
H 3.262904 -2.775490 1.463129
H 3.842990 -2.153418 -1.514716
H 4.838100 -0.935029 1.192080
H 5.845700 -1.107878 -0.266812
H 4.271939 0.558235 -1.499609
H 4.122519 1.374843 1.485503
H 4.383693 3.611386 0.171598
H 3.531573 2.865657 -1.202728
H -7.048684 1.726306 -0.460116
H 2.246500 3.338534 1.612873
H 1.199291 3.586882 -1.291756
H -0.399065 5.094321 0.079629
H -0.057793 4.109022 1.519952
H -1.438284 3.073802 -1.070536
H -2.275548 3.479299 0.457752
H -1.130829 2.098951 0.396343


