%chk=000113585.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000113585

0 1
 O   -1.393900       1.604700     -0.2232000    
 O   -1.428300      -1.589100      0.2204000    
 O   -1.839900      0.7356000      -2.307800    
 O   -1.849600     -0.7185000       2.309400    
 O   5.7799999E-02   2.938200       1.565900    
 O   1.8100001E-02  -2.953300      -1.560400    
 C   -3.417700      0.4559000     -0.5422000    
 C   -3.423400     -0.4202000      0.5432000    
 C   -4.622900      0.9018000      -1.084900    
 C   -4.634400     -0.8503000       1.086000    
 C   -2.146000      0.9326000      -1.142100    
 C   -2.181500     -0.9035000       1.132500    
 C  -0.1530000       2.111200     -0.6786000    
 C  -0.1799000      -2.116800      0.6817000    
 C    1.907700       3.414200      0.1891000    
 C    1.868400      -3.438200     -0.1872000    
 C   -5.833800      0.4715000     -0.5421000    
 C   -5.839500     -0.4045000      0.5433000    
 C   0.5949000       2.843200      0.4437000    
 C   0.5256000      -2.843500     -0.4466000    
 C    2.486500       3.296300      -1.074600    
 C    2.451600      -3.320200       1.074500    
 C    2.588300       4.080400       1.208400    
 C    2.541100      -4.113000      -1.206100    
 C    3.745700       3.844300      -1.319100    
 C    3.707500      -3.876600       1.317200    
 C    3.847500       4.628300      0.9639000    
 C    3.797000      -4.669600     -0.9631000    
 C    4.426100       4.510300     -0.2999000    
 C    4.380000      -4.551300      0.2986000    
 H   -4.632100       1.585700      -1.929700    
 H   -4.653200      -1.534000       1.931000    
 H   0.4648000       1.271400      -1.015600    
 H  -0.3365000       2.821300      -1.492400    
 H   0.4443000      -1.280900       1.014600    
 H  -0.3772000      -2.823800       1.494100    
 H   -6.772200      0.8189000     -0.9644000    
 H   -6.782300     -0.7395000      0.9656000    
 H    1.993500       2.788200      -1.897300    
 H    1.963800      -2.805700       1.896100    
 H    2.159000       4.185600       2.201200    
 H    2.107400      -4.218200      -2.196900    
 H    4.196700       3.753000      -2.302900    
 H    4.161900      -3.785300       2.299500    
 H    4.377800       5.147000       1.757200    
 H    4.321100      -5.195100      -1.756200    
 H    5.406500       4.937100     -0.4902000    
 H    5.357700      -4.984700      0.4876000    


%chk=000113585-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000113585

0 1
O -1.514540 1.355821 -0.316860
O -1.532094 -1.341634 0.316684
O -2.339617 1.140729 -2.487016
O -2.351533 -1.106210 2.486993
O 0.676444 1.169025 1.271602
O 0.662742 -1.174551 -1.269640
C -3.699566 0.412071 -0.596699
C -3.704234 -0.368301 0.595004
C -4.932650 0.769361 -1.197718
C -4.941506 -0.711930 1.195278
C -2.469596 0.958542 -1.253227
C -2.480666 -0.927909 1.252624
C -0.251960 1.842743 -0.887491
C -0.274779 -1.841791 0.887566
C 2.123886 2.504749 -0.122007
C 2.094384 -2.528239 0.122960
C -6.158609 0.398983 -0.607941
C -6.162966 -0.328181 0.604641
C 0.835605 1.796850 0.187705
C 0.814146 -1.805879 -0.186669
C 2.380709 3.118658 -1.378934
C 2.342759 -3.148086 1.378679
C 3.125259 2.543203 0.886256
C 3.096803 -2.574743 -0.883916
C 3.614822 3.759376 -1.617673
C 3.569612 -3.802518 1.617590
C 4.354391 3.187654 0.648097
C 4.318668 -3.232797 -0.645577
C 4.602239 3.798387 -0.605511
C 4.558095 -3.849392 0.606804
H -4.908411 1.350495 -2.124963
H -4.924500 -1.293031 2.122707
H 0.040596 1.191753 -1.734519
H -0.400427 2.870460 -1.267295
H 0.023996 -1.194777 1.735490
H -0.434055 -2.868339 1.266067
H -7.102101 0.686696 -1.083441
H -7.109846 -0.605501 1.079585
H 1.633151 3.092429 -2.178838
H 1.594305 -3.115951 2.177534
H 2.910014 2.060488 1.845356
H 2.888120 -2.087268 -1.842060
H 3.808208 4.226416 -2.589358
H 3.756545 -4.274116 2.588335
H 5.118628 3.216544 1.432219
H 5.083757 -3.267747 -1.428621
H 5.558298 4.300057 -0.792514
H 5.508474 -4.361696 0.793910


