%chk=000128563.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128563

0 1
 O    3.446500       1.775100      0.4369000    
 O   -2.523500      -3.122000      0.2095000    
 O  -0.4415000      -1.936100       1.401000    
 O    2.564900       3.820700      0.7495000    
 O   -5.069800      0.8274000      -1.590900    
 O   -4.306000       2.415700     -9.7499996E-02
 O    5.954200      -1.708100      -1.073000    
 O  -0.4004000      -3.946400     -0.1782000    
 C   -1.811400       1.105200      0.2542000    
 C   0.7943000      0.6627000      0.6965000    
 C  -0.5744000      0.1451000      0.1290000    
 C    1.057600       2.055800      7.9499997E-02
 C   -1.409400       2.516800     -0.2472000    
 C   -2.932500      0.5202000     -0.6804000    
 C  -9.3099996E-02   3.036200      0.3363000    
 C    1.944100     -0.2244000      0.1593000    
 C  -0.9967000      -1.277900      0.5256000    
 C   -3.332700     -0.9077000     -0.2877000    
 C   -2.349100       1.218300       1.702600    
 C   0.8601000      0.6981000       2.240500    
 C   -2.141400      -1.857100     -0.2958000    
 C    3.334200      0.3273000      0.5054000    
 C    2.398600       2.633000      0.4874000    
 C   -4.164300       1.381100     -0.7350000    
 C    4.381600     -0.2911000     -0.3413000    
 C    4.862300      0.1909000      -1.576400    
 C    5.071300      -1.444900     -7.4199997E-02
 C   -1.551100      -4.087900      0.2132000    
 C   -6.297100       1.548500      -1.738400    
 C    5.820700     -0.7078000      -1.983300    
 C   -2.095900      -5.367000      0.7727000    
 H  -0.3898000      4.8599999E-02 -0.9550000    
 H    1.131700       1.952800      -1.014800    
 H   -2.173700       3.265200     -1.8100001E-02
 H   -1.311300       2.501100      -1.341000    
 H   -2.539400      0.5024000      -1.707800    
 H   0.1315000       4.001600     -0.1355000    
 H  -0.1933000       3.248200       1.406200    
 H    1.850700     -0.2999000     -0.9340000    
 H    1.864800      -1.253100      0.5314000    
 H   -4.092900      -1.312700     -0.9678000    
 H   -3.812100     -0.9160000      0.7004000    
 H   -1.849200       2.006900       2.270400    
 H   -3.414800       1.444500       1.770200    
 H   -2.211200      0.2842000       2.257300    
 H    1.805400       1.111300       2.606900    
 H   8.1699997E-02   1.317100       2.683100    
 H   0.7741000     -0.3008000       2.675900    
 H   -1.786500      -1.982000      -1.327300    
 H    3.559000      7.7600002E-02   1.550400    
 H    4.555000       1.077700      -2.112300    
 H    5.056700      -2.159900      0.7357000    
 H   -6.817200       1.610700     -0.7778000    
 H   -6.928800       1.003600      -2.445000    
 H   -6.103100       2.548100      -2.138900    
 H    6.463000     -0.7752000      -2.849100    
 H   -2.925700      -5.717700      0.1541000    
 H   -2.423100      -5.209700       1.803500    
 H   -1.310900      -6.128600      0.7681000    


%chk=000128563-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128563

0 1
O 3.353590 1.879338 0.302092
O -2.455824 -3.326151 0.486155
O -0.342409 -1.966744 1.572226
O 2.398709 3.942088 0.328494
O -4.381538 1.807253 -1.860192
O -5.220355 1.166607 0.213286
O 6.341882 -1.274274 -0.913926
O -0.677651 -4.294718 -0.676100
C -1.934530 0.958494 0.337530
C 0.725762 0.657563 0.661626
C -0.632912 0.053543 0.162437
C 0.862524 2.055756 -0.021114
C -1.633313 2.386141 -0.216179
C -3.039188 0.277474 -0.577613
C -0.313804 2.997395 0.299946
C 1.889689 -0.205107 0.089392
C -0.945910 -1.366139 0.650207
C -3.377119 -1.159164 -0.105783
C -2.431894 1.043279 1.809466
C 0.859438 0.767387 2.205171
C -2.108763 -2.030118 -0.117558
C 3.272348 0.366831 0.451566
C 2.223987 2.709561 0.243040
C -4.317740 1.104111 -0.654180
C 4.392900 -0.211661 -0.361035
C 4.521029 -0.225562 -1.809989
C 5.515332 -0.850678 0.137114
C -1.589492 -4.395370 0.172275
C -5.581095 2.664811 -2.043342
C 5.706067 -0.869202 -2.104948
C -1.939157 -5.610445 0.994248
H -0.517651 -0.040440 -0.944751
H 0.847638 1.875495 -1.122334
H -2.478068 3.053509 0.044003
H -1.597815 2.344855 -1.324596
H -2.632328 0.241734 -1.607294
H -0.139397 3.977578 -0.176845
H -0.357341 3.192180 1.387254
H 1.792540 -0.273273 -1.012576
H 1.843621 -1.234898 0.485902
H -4.129541 -1.618282 -0.771705
H -3.810545 -1.137876 0.908379
H -1.906753 1.839167 2.362673
H -3.508943 1.283554 1.834720
H -2.284014 0.101751 2.367202
H 1.785958 1.302406 2.482121
H 0.026692 1.322509 2.659282
H 0.882115 -0.236035 2.658712
H -1.757370 -2.198336 -1.157526
H 3.476990 0.196230 1.524423
H 3.832456 0.209902 -2.531680
H 5.868767 -1.080292 1.138447
H -6.497597 2.056174 -1.970185
H -5.466214 3.095909 -3.047173
H -5.606578 3.451902 -1.271338
H 6.231703 -1.116232 -3.022334
H -3.028189 -5.688461 1.139650
H -1.473546 -5.510432 1.991665
H -1.546454 -6.516902 0.510593


