%chk=000062298.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062298

0 1
 O   -4.089400      0.5348000       1.696300    
 O   0.3524000      0.6226000      0.8398000    
 O   -3.402300      -2.197100       1.176600    
 O    2.066900     -0.6492000     -0.1021000    
 O    2.080800       2.862300      0.9075000    
 O    4.910500       2.062500       1.092300    
 O    5.547400      0.1156000     -0.9472000    
 O    3.855400      -2.754300      0.1419000    
 C   -3.316900      0.8823000     -0.6202000    
 C   -2.946600      0.8037000      0.8721000    
 C   -4.502200      7.9599999E-02  -1.143900    
 C   -4.619200       1.566300      -1.000700    
 C   -1.880200     -0.2945000       1.094800    
 C  -0.6409000     -0.1567000      0.1762000    
 C   -2.127400      0.9552000      -1.535800    
 C  -0.1247000      -1.597400      4.2199999E-02
 C  -0.9232000      0.4696000      -1.169600    
 C   -2.353700      -1.712100      0.7685000    
 C   -1.377000      -2.454900     -0.1179000    
 C   -2.439600       2.172200       1.362100    
 C   -2.266600       1.619500      -2.881700    
 C   -1.164300      -3.893100      0.3119000    
 C    1.563800      0.6713000      8.6599998E-02
 C    2.568100       1.521200      0.8649000    
 C    3.945000       1.502400      0.2010000    
 C    3.269500     -0.6725000     -0.8730000    
 C    4.379900      7.4900001E-02 -0.1308000    
 C    3.634500      -2.134200      -1.111800    
 H   -4.464100     -0.3289000      -2.147200    
 H   -5.071500     -0.5348000     -0.4567000    
 H   -5.261400       1.943500     -0.2123000    
 H   -4.690700       2.151600      -1.908700    
 H   -1.574800     -0.3141000       2.150200    
 H   0.4315000      -1.916200      0.9344000    
 H   0.4610000      -1.792100     -0.8630000    
 H  -0.1308000      0.4898000      -1.912500    
 H   -1.752500      -2.409300      -1.146700    
 H   -2.152000       2.126600       2.419000    
 H   -1.583400       2.542600      0.7912000    
 H   -3.232900       2.925900       1.290100    
 H   -3.781800      0.4280000       2.612600    
 H   -3.021200       1.112900      -3.491100    
 H   -1.331300       1.606600      -3.452200    
 H   -2.554100       2.668900      -2.760500    
 H  -0.8827000      -3.959600       1.368600    
 H   -2.083900      -4.474000      0.1842000    
 H  -0.3775000      -4.365700     -0.2844000    
 H    1.410600       1.167400     -0.8770000    
 H    2.642300       1.177500       1.903500    
 H    3.949600       2.133500     -0.6964000    
 H    3.079500     -0.2135000      -1.852200    
 H    4.650400     -0.4287000      0.8042000    
 H    2.014900       3.189600     -5.7999999E-03
 H    4.524400      -2.247800      -1.738600    
 H    2.802900      -2.659700      -1.591700    
 H    5.774400       2.024000      0.6472000    
 H    5.319000      0.5708000      -1.775700    
 H    4.767300      -2.557400      0.4147000    


%chk=000062298-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000062298

0 1
O -3.963638 1.013013 1.576383
O 0.447678 -0.033993 0.969324
O -4.007862 -1.767392 1.338428
O 2.260999 -0.689498 -0.380868
O 1.749050 2.485678 1.546163
O 4.620884 2.198774 1.531783
O 5.723178 0.751207 -0.801905
O 5.212201 -2.090516 -1.153594
C -3.076073 0.966455 -0.761651
C -2.741862 0.943131 0.757382
C -4.507325 0.557138 -1.217766
C -4.095475 2.023854 -1.222843
C -1.973408 -0.375110 1.085390
C -0.715898 -0.652383 0.225275
C -1.935432 0.567672 -1.659029
C -0.556113 -2.203603 0.281176
C -0.868383 -0.150256 -1.190284
C -2.814177 -1.650200 0.941360
C -2.002960 -2.755198 0.254570
C -1.923814 2.183519 1.153299
C -1.991459 0.958682 -3.125241
C -2.216935 -4.151910 0.868618
C 1.524080 0.477915 0.213291
C 2.444909 1.256327 1.169772
C 3.780576 1.607101 0.485745
C 3.451369 -0.273842 -1.149310
C 4.434274 0.381854 -0.157719
C 4.057295 -1.519889 -1.845800
H -4.604413 0.032326 -2.172895
H -5.202892 0.230671 -0.441881
H -4.516600 2.647461 -0.429090
H -3.946712 2.527441 -2.181550
H -1.648422 -0.316037 2.146343
H -0.065197 -2.461992 1.238333
H 0.077247 -2.584155 -0.535948
H -0.080680 -0.459967 -1.890097
H -2.365772 -2.768045 -0.797232
H -1.642255 2.128789 2.217656
H -0.998071 2.281210 0.565083
H -2.545056 3.083198 1.003175
H -4.338960 0.086219 1.651036
H -2.938996 0.645580 -3.603201
H -1.160756 0.503581 -3.690797
H -1.924610 2.057217 -3.241397
H -1.827761 -4.189766 1.902317
H -3.291894 -4.400950 0.898977
H -1.692836 -4.923748 0.277880
H 1.186605 1.131095 -0.624403
H 2.658355 0.621559 2.054138
H 3.576397 2.367583 -0.306541
H 3.141719 0.477606 -1.918505
H 4.722998 -0.354654 0.607950
H 2.354027 2.996330 2.143957
H 4.319950 -1.266674 -2.894251
H 3.294871 -2.315376 -1.852448
H 5.550291 2.254160 1.189287
H 5.543863 1.370737 -1.557158
H 5.931079 -1.402530 -1.143489


