%chk=000101762.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101762

0 1
 O   -3.201700     -0.1894000       1.900200    
 O   0.6112000       2.554300     -0.4530000    
 O    5.706700      2.4999999E-03   1.751900    
 O   -4.292700       1.684600     -0.2484000    
 O   -6.803200      0.6550000      0.2097000    
 C   0.4027000      -1.019400     -0.3978000    
 C   -1.014600      -1.104000      0.1890000    
 C   -1.881500      0.1368000     -0.1384000    
 C    1.118400      0.2405000      0.1836000    
 C    2.598900      0.3715000     -0.3258000    
 C    3.332500     -0.9628000      3.9999999E-02
 C   -3.226900     -0.3178000      0.4817000    
 C    1.200100      -2.298500     -0.1084000    
 C   -1.901400      -2.276700     -0.2226000    
 C   -1.216400       1.357100      0.5069000    
 C    2.651400      -2.194800     -0.5677000    
 C   0.2172000       1.483100      3.7000000E-03
 C   -3.334500      -1.811000      0.1040000    
 C    3.342700       1.517900      0.4190000    
 C    4.832900     -0.9398000     -0.2992000    
 C   -2.041700      0.3941000      -1.662800    
 C    2.635700      0.6451000      -1.851200    
 C    4.847800       1.572200      0.1266000    
 C    5.557100      0.2391000      0.3521000    
 C   -4.407400      0.4940000      3.8699999E-02
 C   -5.733100     -0.2338000     -3.1800002E-02
 H   0.3257000     -0.9312000      -1.486000    
 H  -0.8982000      -1.174200       1.283000    
 H    1.174500      0.1127000       1.276400    
 H    3.267700      -1.081600       1.133000    
 H   0.7336000      -3.155900     -0.6074000    
 H    1.180100      -2.512000      0.9681000    
 H   -1.648700      -3.191400      0.3237000    
 H   -1.805800      -2.494100      -1.292500    
 H   -1.156200       1.279600       1.597900    
 H   -1.758500       2.279100      0.2716000    
 H    3.182000      -3.103600     -0.2580000    
 H    2.698400      -2.168100      -1.662200    
 H   -3.956000      -1.993500     -0.7789000    
 H   -3.737900      -2.406200      0.9314000    
 H    3.203300       1.397800       1.501500    
 H    2.921500       2.495100      0.1630000    
 H    5.289000      -1.875300      4.8999999E-02
 H    4.974500     -0.9050000      -1.385300    
 H   -2.580100       1.324600      -1.866900    
 H   -1.078500      0.5014000      -2.170200    
 H   -2.580800     -0.4126000      -2.169400    
 H    2.194400       1.615600      -2.096700    
 H    3.655100      0.6629000      -2.246400    
 H    2.093700     -0.1086000      -2.427700    
 H    5.003100       1.892500     -0.9100000    
 H    5.294500       2.345700      0.7631000    
 H    6.571900      0.2967000     -5.8499999E-02
 H   -3.167100      0.7554000       2.126100    
 H   -5.784200      -1.002200      0.7434000    
 H   -5.857200     -0.6921000      -1.016400    
 H    6.208400      0.7474000       2.124500    
 H   -6.823400       1.294000     -0.5230000    


%chk=000101762-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101762

0 1
O -3.023124 -0.405283 2.180501
O 0.489389 2.482893 -0.602938
O 5.557128 0.064338 1.749693
O -4.667792 1.443053 1.155723
O -6.327335 1.256749 -0.938731
C 0.387735 -1.109373 -0.391468
C -1.009540 -1.221025 0.249327
C -1.908270 0.026071 -0.021937
C 1.103620 0.194919 0.137904
C 2.564652 0.367729 -0.409719
C 3.354711 -0.935774 -0.013591
C -3.237315 -0.456130 0.723570
C 1.249004 -2.358792 -0.081271
C -1.917238 -2.419575 -0.115533
C -1.230595 1.269063 0.603156
C 2.702551 -2.215814 -0.577849
C 0.170219 1.416501 -0.009947
C -3.349374 -1.960674 0.324938
C 3.260243 1.560557 0.324429
C 4.857974 -0.848944 -0.364924
C -2.161859 0.277352 -1.531410
C 2.559858 0.611296 -1.944722
C 4.769244 1.670486 0.006030
C 5.536047 0.362612 0.294855
C -4.438165 0.438564 0.411280
C -5.410267 0.159187 -0.730527
H 0.281228 -1.032928 -1.492729
H -0.864976 -1.252002 1.350858
H 1.190373 0.041579 1.241334
H 3.302604 -1.000103 1.095653
H 0.774086 -3.251220 -0.534010
H 1.255761 -2.521335 1.017702
H -1.613321 -3.345204 0.401074
H -1.883371 -2.624653 -1.202576
H -1.138722 1.110116 1.695310
H -1.791661 2.201700 0.418015
H 3.291874 -3.099116 -0.260203
H 2.728272 -2.204945 -1.686587
H -4.084255 -2.121218 -0.483038
H -3.704091 -2.511677 1.211779
H 3.139275 1.416036 1.418092
H 2.758653 2.505921 0.056764
H 5.370361 -1.766705 -0.018216
H 5.004718 -0.791116 -1.461116
H -2.795097 1.170466 -1.684063
H -1.214198 0.474672 -2.061527
H -2.643650 -0.582580 -2.029912
H 2.064446 1.569961 -2.171913
H 3.585395 0.655570 -2.351693
H 2.031158 -0.187607 -2.494857
H 4.915889 1.937200 -1.059349
H 5.214105 2.501164 0.592779
H 6.583425 0.453468 -0.068140
H -3.352867 0.485600 2.487561
H -5.966005 -0.767217 -0.455812
H -4.875721 -0.045832 -1.674947
H 5.942989 0.843705 2.224358
H -6.249178 1.861016 -0.147227


