%chk=000102003.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102003

0 1
 O    3.034300      0.2782000       1.815700    
 O  -0.3381000      -2.127700      -1.355600    
 O    3.794000       2.642300      0.9143000    
 O    5.278000      4.2300001E-02 -0.5554000    
 O    5.630000      -2.359900      0.7506000    
 O   -6.485500     -6.5300003E-02   1.420000    
 C    1.798800     -0.1602000     -0.2587000    
 C   0.9003000       1.067700      1.7300000E-02
 C  -0.5152000      0.9375000     -0.5655000    
 C   -1.207600     -0.3134000      6.7199998E-02
 C    3.114800      0.3455000      0.3955000    
 C    1.132100      -1.377600      0.4155000    
 C   -2.715500     -0.4790000     -0.3871000    
 C  -0.3284000      -1.598600     -3.7400000E-02
 C    1.764700       2.260300     -0.3987000    
 C    3.209000       1.815900     -8.0600001E-02
 C   -1.332900       2.205200     -0.2722000    
 C    2.027900     -0.4266000      -1.771600    
 C   -3.448400      0.8561000     -0.1975000    
 C   -2.767600       2.079100     -0.7615000    
 C   -3.369300      -1.575400      0.5037000    
 C   -2.874100     -0.8781000      -1.871700    
 C    4.330500     -0.4596000      4.7400001E-02
 C   -4.889000      -1.569200      0.4590000    
 C   -4.647500      0.9800000      0.3958000    
 C   -5.414800     -0.2086000      0.8335000    
 C    4.319500      -1.910800      0.4780000    
 H   0.7707000       1.163100       1.108400    
 H  -0.4594000      0.8210000      -1.652600    
 H   -1.247400     -9.6500002E-02   1.148300    
 H    1.124400      -1.250200       1.504800    
 H    1.699400      -2.288700      0.2036000    
 H  -0.7564000      -2.372600      0.6097000    
 H    1.657900       2.451300      -1.472900    
 H    1.483100       3.172700      0.1370000    
 H    3.804100       1.933700     -0.9934000    
 H  -0.8718000       3.071500     -0.7608000    
 H   -1.331700       2.412600      0.8061000    
 H    2.548600      -1.377500      -1.927000    
 H    1.099400     -0.4754000      -2.343400    
 H    2.634200      0.3488000      -2.250200    
 H   -2.778700       2.021700      -1.856900    
 H   -3.310800       2.995000     -0.4977000    
 H   -3.062000      -1.429600       1.548800    
 H   -3.014500      -2.571600      0.2134000    
 H   -2.643700      -1.934900      -2.038400    
 H   -3.904200     -0.7325000      -2.219700    
 H   -2.230500     -0.2874000      -2.530800    
 H    3.780600      0.7795000       2.185900    
 H   -5.272800      -2.301000       1.178500    
 H   -5.268900      -1.833900     -0.5328000    
 H   0.1748000      -2.953600      -1.348600    
 H   -5.129100       1.944000      0.5203000    
 H    4.712100       2.345500       1.035000    
 H    3.911700      -2.521100     -0.3308000    
 H    3.728200      -2.060800       1.383500    
 H    5.954400      -1.865100       1.522500    


%chk=000102003-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000102003

0 1
O 2.902099 0.205732 1.915540
O -0.468935 -2.180309 -1.406118
O 3.697449 2.545925 1.152908
O 5.068989 -0.368766 -0.874275
O 5.793127 -2.549007 0.508861
O -6.578714 -0.130363 1.486602
C 1.770873 -0.242680 -0.258983
C 0.899861 1.034008 -0.031821
C -0.517640 0.937428 -0.629936
C -1.241827 -0.291631 0.004345
C 3.101459 0.234071 0.463402
C 1.060576 -1.426900 0.430055
C -2.753404 -0.451585 -0.451720
C -0.410362 -1.605920 -0.037789
C 1.827464 2.199658 -0.447321
C 3.244800 1.741047 -0.010119
C -1.307146 2.229633 -0.303820
C 2.063391 -0.528602 -1.755900
C -3.469701 0.880033 -0.158866
C -2.802782 2.136488 -0.686665
C -3.396968 -1.604513 0.378748
C -2.922964 -0.737238 -1.980105
C 4.332521 -0.606870 0.129368
C -4.939195 -1.584035 0.385343
C -4.681617 0.947390 0.480931
C -5.479754 -0.236149 0.859377
C 4.685043 -1.782053 1.037203
H 0.769175 1.107097 1.070103
H -0.458317 0.812339 -1.729642
H -1.301372 -0.059941 1.094407
H 1.069785 -1.249317 1.522247
H 1.597665 -2.383651 0.254187
H -0.883690 -2.333799 0.654970
H 1.793053 2.371497 -1.539002
H 1.577291 3.149753 0.052812
H 3.989933 1.804741 -0.821737
H -0.849690 3.093923 -0.822249
H -1.223767 2.426493 0.785449
H 2.622121 -1.476267 -1.869736
H 1.124312 -0.632767 -2.319939
H 2.678863 0.258969 -2.224283
H -2.881764 2.135152 -1.794405
H -3.347141 3.031604 -0.334191
H -3.047052 -1.525584 1.429041
H -3.041515 -2.575058 -0.013257
H -2.472171 -1.707068 -2.235046
H -3.995177 -0.742509 -2.249468
H -2.429830 0.030355 -2.601518
H 3.206869 1.110094 2.232032
H -5.353191 -2.379502 1.029741
H -5.333916 -1.763704 -0.635563
H 0.162174 -2.943171 -1.446946
H -5.146012 1.920017 0.691539
H 4.661300 2.748787 1.070558
H 3.795525 -2.431556 1.161060
H 4.923776 -1.385407 2.044444
H 6.117821 -2.068215 -0.305055


