%chk=000146611.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146611

0 1
 O    2.930100      -1.269500       1.053900    
 O    2.813800      -2.681200     -0.8499000    
 O    2.014300       3.596500      -1.261700    
 O    3.987100       3.291200      8.6999997E-02
 O   -3.072500      0.6830000       2.538400    
 O   -4.181200     -0.3340000      -2.008700    
 O   -4.940800      0.5708000      0.4958000    
 C   0.7880000      -2.271500      0.4441000    
 C   0.4095000      -1.048500     -0.4464000    
 C    2.327000      -2.440800      0.4747000    
 C    1.407200      8.9900002E-02 -0.2918000    
 C   6.1999999E-02  -3.534200     -4.7300000E-02
 C   -1.031300     -0.6119000     -0.1924000    
 C    2.591100     -8.5600004E-02  0.4553000    
 C    2.761400      -3.608700       1.367400    
 C    1.177900       1.327900     -0.9226000    
 C    3.497000      0.9662000      0.6414000    
 C   -1.958300     -0.6719000      -1.225300    
 C   -1.399400     -0.1595000       1.068700    
 C    2.094900       2.343100     -0.7378000    
 C    3.219900       2.169100      2.9800000E-02
 C    4.222900      -2.841200     -0.8581000    
 C   -2.715900      0.2393000       1.300400    
 C   -3.274700     -0.2729000     -0.9936000    
 C   -3.653600      0.1825000      0.2693000    
 C    3.216100       4.193000     -0.7328000    
 C   -2.941400       2.080900       2.788200    
 C   -4.911500      -1.550600      -2.153000    
 C   -5.439800       1.648400     -0.2931000    
 H   0.4664000      -2.082600       1.477500    
 H   0.4995000      -1.365800      -1.496300    
 H   0.3647000      -3.799900      -1.065400    
 H   0.2699000      -4.389500      0.6026000    
 H   -1.023700      -3.395500     -4.4599999E-02
 H    2.230500      -3.578500       2.326100    
 H    2.578900      -4.579800      0.8959000    
 H    3.825700      -3.556300       1.625000    
 H   0.2991000       1.495500      -1.536900    
 H    4.397200      0.8341000       1.232300    
 H   -1.669700      -1.025400      -2.211700    
 H  -0.6764000     -0.1023000       1.878100    
 H    4.551200      -2.771400      -1.900100    
 H    4.512000      -3.835900     -0.5066000    
 H    4.752600      -2.063500     -0.3004000    
 H    3.839900       4.526900      -1.569900    
 H    2.939100       5.065600     -0.1301000    
 H   -3.571700       2.657000       2.103600    
 H   -1.896500       2.391700       2.687800    
 H   -3.267700       2.277900       3.812900    
 H   -5.493100      -1.761100      -1.250000    
 H   -4.232000      -2.382200      -2.365000    
 H   -5.600700      -1.438300      -2.994400    
 H   -4.641600       2.316300     -0.6356000    
 H   -6.126600       2.230300      0.3286000    
 H   -6.003200       1.259600      -1.145800    


%chk=000146611-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000146611

0 1
O 3.240008 -1.324018 0.895141
O 2.655581 -2.860840 -0.866880
O 2.290159 3.721935 -1.313201
O 4.377349 3.319892 -0.203292
O -2.849160 1.390981 2.243363
O -4.035256 -0.488503 -2.186700
O -4.836833 0.969582 0.180012
C 0.907112 -2.138703 0.604067
C 0.588350 -1.001198 -0.420350
C 2.410655 -2.505892 0.526901
C 1.623004 0.126500 -0.321208
C 0.003865 -3.370005 0.386138
C -0.847373 -0.496579 -0.255932
C 2.878081 -0.089317 0.305804
C 2.861078 -3.581347 1.520132
C 1.353124 1.405222 -0.893291
C 3.869502 0.925056 0.412927
C -1.809604 -0.733371 -1.264755
C -1.245765 0.180674 0.922317
C 2.323771 2.397055 -0.786034
C 3.556121 2.163540 -0.139476
C 4.036443 -3.238967 -1.201028
C -2.569668 0.643290 1.083987
C -3.138485 -0.282358 -1.112233
C -3.527520 0.440144 0.049004
C 3.474707 4.386162 -0.718862
C -4.021347 0.973049 3.043700
C -5.248416 -1.271686 -1.856610
C -5.086158 2.131407 -0.710188
H 0.743931 -1.742659 1.626811
H 0.680852 -1.455082 -1.427894
H 0.227595 -3.842502 -0.586850
H 0.144825 -4.124775 1.179662
H -1.058607 -3.071794 0.393162
H 2.479354 -3.347502 2.528272
H 2.484895 -4.571930 1.216514
H 3.961872 -3.613892 1.576240
H 0.397270 1.598698 -1.387190
H 4.821285 0.717729 0.905713
H -1.546787 -1.269415 -2.182750
H -0.529947 0.392324 1.723495
H 4.060984 -3.299353 -2.300052
H 4.302929 -4.224668 -0.772834
H 4.753025 -2.473614 -0.850995
H 4.001659 4.951234 -1.502124
H 3.150474 5.018695 0.130811
H -3.866127 -0.050301 3.437658
H -4.944626 1.012836 2.442502
H -4.067013 1.689954 3.877704
H -5.819972 -0.790479 -1.043459
H -4.966113 -2.300943 -1.563348
H -5.839400 -1.296678 -2.784926
H -4.401207 2.959656 -0.451688
H -6.129281 2.429500 -0.522845
H -4.951597 1.839955 -1.767546


