%chk=000078784.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078784

0 1
 O  -4.4999998E-03 -0.5628000      -1.536300    
 O   -2.586100       3.750300      -1.209700    
 O   -6.071800      -1.933600     -5.5900000E-02
 O    2.429100       3.794500      -1.212100    
 O    6.033200      -2.079900     -1.3600000E-02
 O   -2.411300       3.435400       1.033000    
 O   -4.627500      -2.419100      -1.740500    
 O    2.571400       3.394100       1.019200    
 O    4.654500      -2.270100      -1.808600    
 C   -1.334100     -0.7043000      0.4712000    
 C    1.331800     -0.7013000      0.4668000    
 C   -1.243000      -1.566300       1.741800    
 C    1.246700      -1.563500       1.737700    
 C  -2.4000001E-03 -0.6878000     -0.3064000    
 C   3.0000000E-03  -1.294300       2.572300    
 C   -1.746100      0.7376000      0.8032000    
 C   -2.426400      -1.311700     -0.4344000    
 C    1.741500      0.7415000      0.7978000    
 C    2.422700      -1.306000     -0.4423000    
 C   -1.922900       1.587500     -0.4425000    
 C   -3.770500      -1.378100      0.2626000    
 C    1.940400       1.584300     -0.4495000    
 C    3.775400      -1.342700      0.2402000    
 C   -2.334400       2.999900     -0.1089000    
 C   -4.842700      -1.955600     -0.6276000    
 C    2.335400       3.001600     -0.1164000    
 C    4.838600      -1.949600     -0.6412000    
 H   -1.247400      -2.631900       1.475400    
 H   -2.108300      -1.399300       2.394000    
 H    1.252700      -2.629200       1.471300    
 H    2.113400      -1.395300       2.387600    
 H   4.9999999E-03  -1.955600       3.447000    
 H   2.7000001E-03 -0.2692000       2.956800    
 H   -1.004100       1.214000       1.447900    
 H   -2.658200      0.7667000       1.410500    
 H   -2.124500      -2.333500     -0.7101000    
 H   -2.515000     -0.8026000      -1.400600    
 H    2.645800      0.7675000       1.417500    
 H   0.9929000       1.225200       1.429100    
 H    2.492900     -0.8055000      -1.414800    
 H    2.133100      -2.335000     -0.7038000    
 H   -2.730200       1.203600      -1.072400    
 H   -1.015600       1.660000      -1.038300    
 H   -3.738700      -2.020700       1.147100    
 H   -4.129300     -0.3855000      0.5470000    
 H    2.762200       1.204900      -1.063300    
 H    1.043600       1.643300      -1.062700    
 H    4.137300     -0.3416000      0.4884000    
 H    3.752000      -1.955500       1.145800    
 H   -2.840200       4.668600     -0.9767000    
 H   -6.755400      -2.323100     -0.6417000    
 H    2.698100       4.709000     -0.9804000    
 H    6.716700      -2.464300     -0.6030000    


%chk=000078784-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000078784

0 1
O -0.055083 -0.341546 -1.457050
O -2.641886 3.927493 -1.010075
O -6.090329 -2.155252 -0.507658
O 2.331776 4.073343 -0.921193
O 6.031497 -1.889376 -0.654607
O -0.963089 3.544945 0.542713
O -4.364019 -3.254765 -1.603084
O 2.921146 3.436543 1.230108
O 4.320828 -3.234884 -1.459367
C -1.412327 -0.706545 0.525899
C 1.323416 -0.650452 0.526363
C -1.291519 -1.480813 1.873189
C 1.227101 -1.450175 1.861922
C -0.046232 -0.584083 -0.214323
C -0.032635 -1.125965 2.685552
C -1.892572 0.766403 0.827066
C -2.408177 -1.439868 -0.429519
C 1.768543 0.822860 0.865744
C 2.338988 -1.341959 -0.440414
C -2.210787 1.631717 -0.415427
C -3.847920 -1.536738 0.112937
C 1.966760 1.766744 -0.334714
C 3.796802 -1.346190 0.063480
C -1.858182 3.090877 -0.207690
C -4.731386 -2.403657 -0.765372
C 2.448836 3.132603 0.112461
C 4.680933 -2.257873 -0.767669
H -1.273030 -2.569232 1.657494
H -2.198506 -1.292594 2.480544
H 1.226811 -2.535784 1.631897
H 2.133731 -1.252799 2.466103
H -0.022405 -1.714233 3.622750
H -0.043104 -0.061616 2.988053
H -1.129767 1.289620 1.429964
H -2.791996 0.695376 1.468459
H -2.033058 -2.462319 -0.623820
H -2.414388 -0.935355 -1.410649
H 2.715441 0.760267 1.434156
H 1.044430 1.288995 1.557452
H 2.287161 -0.859078 -1.431451
H 2.021001 -2.389251 -0.601564
H -3.267107 1.562776 -0.725463
H -1.612762 1.285503 -1.284543
H -3.867657 -1.991566 1.123625
H -4.331460 -0.548749 0.212652
H 2.715468 1.368629 -1.047600
H 1.043508 1.897649 -0.921934
H 4.249617 -0.339518 0.069208
H 3.858147 -1.716767 1.106803
H -2.341053 4.870090 -0.894142
H -6.645159 -2.758266 -1.074090
H 2.659144 4.954692 -0.592890
H 6.588009 -2.524858 -1.182787


