%chk=000006011.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006011

0 1
 O    5.335100      -1.330700      0.2026000    
 O   -5.407600      0.4855000      0.7915000    
 C   7.1000000E-03 -0.3393000      0.2026000    
 C   0.9145000      0.8658000     -0.2095000    
 C    2.297900      0.6742000      0.4210000    
 C   -1.456300     -0.1959000     -0.3641000    
 C    2.983200     -0.6292000     -3.3799998E-02
 C   -2.017500       1.177100      0.1281000    
 C   0.6814000      -1.705100     -9.8099999E-02
 C    2.122300      -1.808800      0.4351000    
 C   0.2876000       2.201700      0.2115000    
 C    3.371000       1.737000      0.1987000    
 C    4.326000     -0.4769000      0.7063000    
 C   -1.140800       2.358600     -0.3019000    
 C   -2.375600      -1.307500      0.2235000    
 C    4.689000       1.009200      0.5198000    
 C   -3.476900       1.406900     -0.2698000    
 C   -1.462000     -0.3093000      -1.908900    
 C    3.219600     -0.7371000      -1.562000    
 C   -3.864900      -1.141300     -0.1198000    
 C   -4.337000      0.2655000      0.2253000    
 C   -4.696000      -2.200500      0.6022000    
 H  -8.1299998E-02 -0.2967000       1.300100    
 H    1.024100      0.8891000      -1.298600    
 H    2.143700      0.6232000       1.512200    
 H   -1.999400       1.155900       1.229500    
 H   0.6854000      -1.900400      -1.174700    
 H   0.1025000      -2.515000      0.3593000    
 H    2.086200      -1.835200       1.532000    
 H    2.563700      -2.761400      0.1186000    
 H   0.8911000       3.036300     -0.1639000    
 H   0.2856000       2.282400       1.306200    
 H    3.228200       2.606400      0.8484000    
 H    3.374500       2.093800     -0.8372000    
 H    4.210900     -0.6854000       1.777500    
 H   -1.555300       3.293200      9.5700003E-02
 H   -1.136400       2.461800      -1.393200    
 H   -2.261300      -1.319000       1.316400    
 H   -2.051100      -2.292500     -0.1333000    
 H    5.421400       1.157000     -0.2816000    
 H    5.138300       1.404100       1.438000    
 H   -3.607200       1.503900      -1.351700    
 H   -3.843600       2.333300      0.1883000    
 H  -0.7785000      0.3977000      -2.385400    
 H   -1.171600      -1.313900      -2.233700    
 H   -2.450000     -0.1215000      -2.338200    
 H    3.872500      5.5399999E-02  -1.941000    
 H    3.695400      -1.692500      -1.812400    
 H    2.292200     -0.6857000      -2.138400    
 H   -4.018900      -1.273200      -1.196900    
 H    5.026200      -2.245800      0.3145000    
 H   -5.753200      -2.122400      0.3260000    
 H   -4.355800      -3.208100      0.3420000    
 H   -4.629600      -2.086300       1.689900    


%chk=000006011-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006011

0 1
O 5.448566 -1.348060 0.297674
O -5.395006 0.458520 1.031498
C -0.004940 -0.320469 0.175785
C 0.913036 0.879874 -0.243414
C 2.302361 0.678490 0.393774
C -1.475685 -0.180509 -0.382179
C 2.992075 -0.652764 -0.038700
C -2.032369 1.200314 0.120495
C 0.656145 -1.694067 -0.142599
C 2.098155 -1.828672 0.418136
C 0.285719 2.234209 0.170058
C 3.408154 1.753302 0.199000
C 4.337478 -0.493930 0.739561
C -1.163487 2.392001 -0.336982
C -2.380348 -1.292304 0.234095
C 4.739854 0.991503 0.523429
C -3.532769 1.408405 -0.230294
C -1.496745 -0.290981 -1.932156
C 3.278087 -0.736039 -1.559654
C -3.903476 -1.145474 -0.079515
C -4.385036 0.260419 0.302645
C -4.739643 -2.255036 0.582468
H -0.094503 -0.258551 1.287171
H 1.030621 0.880450 -1.347642
H 2.129946 0.594222 1.493726
H -1.967025 1.166883 1.232289
H 0.676506 -1.855517 -1.237415
H 0.040643 -2.509790 0.280702
H 2.056070 -1.840644 1.528632
H 2.522494 -2.803307 0.097944
H 0.913736 3.065659 -0.204321
H 0.290295 2.307263 1.279240
H 3.256830 2.625602 0.858629
H 3.410118 2.131280 -0.841142
H 4.130348 -0.685789 1.818212
H -1.597475 3.335961 0.049015
H -1.176899 2.469229 -1.443205
H -2.250225 -1.294042 1.337407
H -2.063989 -2.289531 -0.126190
H 5.455538 1.036067 -0.316560
H 5.253253 1.400301 1.410539
H -3.653548 1.475576 -1.331224
H -3.904110 2.354666 0.202619
H -0.782172 0.400874 -2.409997
H -1.234573 -1.315124 -2.254255
H -2.494068 -0.066437 -2.350568
H 3.810319 0.157382 -1.929577
H 3.926040 -1.605414 -1.771070
H 2.352853 -0.845056 -2.150364
H -4.017755 -1.218631 -1.183576
H 5.239017 -2.289366 0.525506
H -5.811227 -2.139112 0.347179
H -4.405686 -3.250894 0.237633
H -4.642695 -2.214536 1.682236


