%chk=000021848.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021848

0 1
 O    3.877800     -0.8054000      -1.716500    
 O    4.136300       1.576100      0.8561000    
 O   -6.141100      0.1553000      -1.138500    
 C    1.896400      0.1338000     -0.6062000    
 C    1.452300      0.1267000      0.8757000    
 C  -7.0900001E-02  0.1000000       1.139800    
 C  -0.8438000     -0.9298000      0.2731000    
 C    1.102100     -0.9311000      -1.404500    
 C    3.403600     -0.2554000     -0.5015000    
 C   -2.403000     -0.7763000      0.4855000    
 C  -0.4109000     -0.8469000      -1.210900    
 C    2.170600      -1.105900       1.467700    
 C    3.439000      -1.220500      0.6613000    
 C    1.709400       1.502800      -1.287500    
 C  -0.6813000       1.476500       1.014900    
 C   -2.859000      0.6620000      0.1938000    
 C   -3.168600      -1.772900     -0.4302000    
 C   -1.924400       1.739500      0.5678000    
 C   -2.756300      -1.109500       1.962500    
 C    4.326000      0.8826000     -0.1419000    
 C   -4.677900      -1.583100     -0.3962000    
 C   -4.059700      0.9211000     -0.3601000    
 C    4.413600      -2.091600      0.9537000    
 C   -5.038500     -0.1489000     -0.6852000    
 C   -2.382800       3.174400      0.4899000    
 C    5.490900       1.126300      -1.062600    
 H    1.859000       1.009700       1.387500    
 H  -0.1822000     -0.1771000       2.196600    
 H  -0.5671000      -1.935100      0.6207000    
 H    1.419700      -1.943500      -1.123000    
 H    1.322200     -0.8401000      -2.476100    
 H  -0.7980000      6.1999999E-02  -1.682900    
 H  -0.8357000      -1.687700      -1.769600    
 H    1.579000      -2.020100       1.355700    
 H    2.378500     -0.9525000       2.532100    
 H    2.132500       2.318700     -0.6928000    
 H    2.191200       1.522700      -2.271100    
 H   0.6557000       1.748400      -1.444400    
 H  -5.4699998E-02   2.307700       1.333000    
 H   -2.921200      -2.806800     -0.1602000    
 H   -2.869600      -1.640500      -1.476000    
 H   -2.441200      -2.128000       2.216400    
 H   -2.282300     -0.4285000       2.676100    
 H   -3.831600      -1.038200       2.156600    
 H   -5.109100      -1.870200      0.5669000    
 H   -5.132400      -2.214100      -1.168500    
 H    3.620700     -0.2172000      -2.446200    
 H   -4.400900       1.927600     -0.5774000    
 H    5.308400      -2.156900      0.3444000    
 H    4.334000      -2.753900       1.809000    
 H   -3.280300       3.330300       1.098400    
 H   -2.598600       3.456900     -0.5461000    
 H   -1.622800       3.872700      0.8588000    
 H    6.118600      0.2341000      -1.129700    
 H    5.138300       1.433700      -2.050100    
 H    6.103200       1.937000     -0.6552000    


%chk=000021848-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000021848

0 1
O 3.909939 -0.775936 -1.828242
O 4.029527 1.821189 0.719794
O -6.304867 -0.047791 -1.018403
C 1.880737 0.276714 -0.676680
C 1.447280 0.254509 0.831284
C -0.087882 0.198861 1.090157
C -0.834318 -0.871002 0.240297
C 1.087138 -0.812652 -1.460638
C 3.391059 -0.183292 -0.589124
C -2.383475 -0.796299 0.511521
C -0.441601 -0.722811 -1.252317
C 2.219383 -0.952053 1.457142
C 3.379122 -1.251810 0.512614
C 1.713423 1.653396 -1.358085
C -0.746315 1.555486 0.935513
C -2.908586 0.616038 0.193460
C -3.139584 -1.851205 -0.349511
C -2.036408 1.764800 0.512315
C -2.653995 -1.083051 2.024588
C 4.386083 0.921530 -0.087828
C -4.674665 -1.715741 -0.276437
C -4.185373 0.802753 -0.299913
C 4.248870 -2.286825 0.573395
C -5.136154 -0.287354 -0.574607
C -2.579767 3.177757 0.374181
C 5.818731 0.831720 -0.589511
H 1.836700 1.178099 1.296965
H -0.183789 -0.083868 2.164040
H -0.504640 -1.880083 0.571724
H 1.440284 -1.816785 -1.154035
H 1.314476 -0.730122 -2.541231
H -0.832118 0.232969 -1.651965
H -0.908051 -1.526773 -1.849450
H 1.573391 -1.845862 1.550317
H 2.573523 -0.706063 2.475238
H 2.199200 2.456032 -0.778947
H 2.149038 1.648071 -2.379292
H 0.646275 1.911396 -1.468427
H -0.131543 2.428159 1.201446
H -2.828384 -2.867026 -0.034439
H -2.846430 -1.736970 -1.408818
H -2.194086 -2.045706 2.319044
H -2.247390 -0.289624 2.674424
H -3.736519 -1.141570 2.229582
H -5.056529 -1.989939 0.727339
H -5.173896 -2.395376 -0.990102
H 3.766594 -0.136357 -2.572122
H -4.572248 1.808086 -0.501898
H 5.016611 -2.426763 -0.194300
H 4.186370 -3.039934 1.367568
H -3.483075 3.329451 0.994258
H -2.863748 3.403283 -0.671470
H -1.824063 3.918692 0.684678
H 6.158127 -0.214289 -0.657377
H 5.889052 1.254534 -1.610663
H 6.471667 1.418308 0.075848


