%chk=000065554.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065554

0 1
 O   -3.071000      0.2607000      -1.950400    
 O   0.4743000      -2.496900      0.7645000    
 O   -5.094600      0.2578000      0.8084000    
 O    5.912200     -0.3846000      -1.857500    
 O   -5.990700      -1.971700     -0.3938000    
 C  -0.9190000       1.206600     -0.2126000    
 C   0.4537000       1.106200      0.4665000    
 C   -1.872500      5.1800001E-02  0.1788000    
 C    1.127100     -0.2377000      7.4100003E-02
 C    2.545000     -0.4215000      0.7285000    
 C   -3.156500      0.5193000     -0.5518000    
 C    3.435700      0.8489000      0.4732000    
 C   -1.755000       2.460600      3.6899999E-02
 C    1.355200       2.279900      6.9799997E-02
 C   -1.250000      -1.255700     -0.3186000    
 C   -3.196700       2.042900     -0.3123000    
 C    2.714600       2.177000      0.7436000    
 C   0.1482000      -1.421300      0.2638000    
 C    3.235300      -1.684600      0.1099000    
 C   -2.119600     -5.1800001E-02   1.709300    
 C    4.059600      0.8229000     -0.9302000    
 C    2.440000     -0.6161000       2.261800    
 C    4.735800      -1.527500     -0.1090000    
 C   -4.413100     -0.1741000     -0.1201000    
 C    4.988600     -0.3670000      -1.044800    
 C   -4.786700      -1.424300     -0.8879000    
 H  -0.7395000       1.164100      -1.299400    
 H   0.3122000       1.147800       1.552000    
 H    1.282700     -0.2091000      -1.015600    
 H    4.277200      0.8230000       1.182500    
 H   -1.425800       3.299500     -0.5850000    
 H   -1.694100       2.782200       1.082700    
 H   0.8925000       3.229100      0.3637000    
 H    1.479800       2.314500      -1.019300    
 H   -1.151700      -1.285800      -1.409200    
 H   -1.854900      -2.116600     -1.5200000E-02
 H   -3.856100       2.336600      0.5115000    
 H   -3.532400       2.583900      -1.204500    
 H    3.342600       3.018100      0.4257000    
 H    2.580300       2.298400       1.825900    
 H    2.784700      -1.913000     -0.8654000    
 H    3.062600      -2.566900      0.7377000    
 H   -2.804200     -0.8774000       1.935900    
 H   -1.201600     -0.2552000       2.268900    
 H   -2.556700      0.8595000       2.128800    
 H    4.654300       1.728000      -1.096900    
 H    3.302900      0.7519000      -1.717000    
 H    1.854500      -1.499700       2.530200    
 H    3.434200     -0.7507000       2.704100    
 H    1.978600      0.2416000       2.759000    
 H    5.139000      -2.438300     -0.5643000    
 H    5.263500      -1.349700      0.8332000    
 H   -3.772500      0.7627000      -2.399800    
 H   -4.004800      -2.176800     -0.7756000    
 H   -4.941000      -1.205500      -1.947200    
 H   -6.699900      -1.331200     -0.5742000    


%chk=000065554-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000065554

0 1
O -2.891657 0.249061 -2.063043
O 0.459170 -2.470678 0.891810
O -5.169582 0.166493 0.746427
O 5.934292 -0.416845 -1.956228
O -6.021019 -2.085671 -0.425595
C -0.925949 1.255042 -0.187247
C 0.440932 1.150726 0.514364
C -1.887031 0.072782 0.162252
C 1.126222 -0.211285 0.128773
C 2.545141 -0.428613 0.767742
C -3.175863 0.540016 -0.636918
C 3.452794 0.832097 0.482149
C -1.788500 2.519473 0.040782
C 1.373814 2.320174 0.122457
C -1.241072 -1.247063 -0.327918
C -3.235483 2.075324 -0.357214
C 2.753591 2.179173 0.794554
C 0.153701 -1.402866 0.295506
C 3.204184 -1.699988 0.106867
C -2.198645 -0.032258 1.677249
C 4.056421 0.790782 -0.945113
C 2.461732 -0.631151 2.306498
C 4.722875 -1.562441 -0.154856
C -4.453919 -0.200623 -0.230139
C 5.005564 -0.401480 -1.106071
C -4.863849 -1.448235 -1.012248
H -0.740532 1.177237 -1.280427
H 0.295535 1.183267 1.613989
H 1.273379 -0.144248 -0.977194
H 4.310543 0.759017 1.184197
H -1.437981 3.373176 -0.563825
H -1.753698 2.832883 1.100878
H 0.913064 3.281928 0.419391
H 1.479540 2.346680 -0.982581
H -1.154210 -1.212451 -1.431334
H -1.828096 -2.139481 -0.046918
H -3.960697 2.268450 0.451424
H -3.602424 2.612637 -1.253149
H 3.415678 3.011584 0.485146
H 2.623450 2.277628 1.890685
H 2.712009 -1.912033 -0.863362
H 3.003941 -2.580781 0.738455
H -2.865148 -0.887821 1.884634
H -1.272842 -0.199913 2.254747
H -2.692388 0.870778 2.073188
H 4.612964 1.715949 -1.183888
H 3.264567 0.701414 -1.718099
H 1.809226 -1.482808 2.555926
H 3.469420 -0.843877 2.712092
H 2.081916 0.266838 2.827542
H 5.150551 -2.487230 -0.580607
H 5.263968 -1.373101 0.796146
H -3.411382 0.876037 -2.626893
H -4.008479 -2.153468 -1.045886
H -5.074701 -1.164168 -2.063279
H -6.308736 -1.521272 0.347464


