%chk=000162708.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162708

0 1
 O    5.007300     -0.5358000     -0.9845000    
 O   -3.637300      0.9093000       1.059400    
 O   -4.749000      -1.125600      -2.016000    
 O   -4.418400       2.891400      0.1661000    
 C    2.740100      0.2150000     -0.3313000    
 C    2.171800      -1.226600     -9.7300000E-02
 C   0.7703000      -1.279200      0.5700000    
 C  -0.1496000     -0.1519000      3.3399999E-02
 C    4.248600      7.7600002E-02  6.2600002E-02
 C    1.977400       1.221100      0.5654000    
 C    3.221600      -1.971500      0.7583000    
 C   0.4609000       1.227900      0.3511000    
 C   -1.594300     -0.2792000      0.5931000    
 C    4.219600     -0.9173000       1.219900    
 C   0.1453000      -2.681800      0.3863000    
 C    2.587100      0.6368000      -1.809700    
 C   -1.283700      -2.764500      0.9202000    
 C   -2.097500      -1.674900      0.2811000    
 C   -2.572100      0.8081000      0.1056000    
 C    3.168800       1.985200      -2.043600    
 C    4.900800       1.335500      0.4504000    
 C   -3.166500      0.5131000      -1.264600    
 C   -3.115500      -1.952800     -0.5457000    
 C   -3.776200     -0.8694000      -1.309100    
 C    5.433400       2.363500      0.7675000    
 C   -4.587100       1.844700      0.7771000    
 C   -5.905800       1.401300       1.334200    
 H    2.109700      -1.744200      -1.064600    
 H   0.8862000      -1.120400       1.652500    
 H  -0.2038000     -0.2587000      -1.059000    
 H    2.349800       2.246700      0.4915000    
 H    2.146700      0.9536000       1.617700    
 H    3.732200      -2.715600      0.1341000    
 H    2.799400      -2.508100       1.613300    
 H   3.5000001E-03   1.653500       1.253300    
 H   0.2161000       1.918300     -0.4659000    
 H   -1.541400     -0.1949000       1.689100    
 H    3.871600     -0.4543000       2.151100    
 H    5.195700      -1.373600       1.420100    
 H   0.7561000      -3.437700      0.8931000    
 H   0.1434000      -2.945100     -0.6800000    
 H    1.535000      0.6454000      -2.110800    
 H    3.068900     -9.0300001E-02  -2.474800    
 H   -1.293100      -2.644700       2.010000    
 H   -1.695500      -3.757700      0.7058000    
 H   -2.071600       1.781900      8.3899997E-02
 H    2.735000       2.783100      -1.438500    
 H    4.256500       2.007700      -1.952100    
 H    2.968600       2.273200      -3.083800    
 H    5.909800     -0.6920000     -0.6571000    
 H   -2.383700      0.5484000      -2.031700    
 H   -3.940100       1.225600      -1.563100    
 H   -3.438500      -2.968900     -0.7423000    
 H    5.904900       3.276000       1.048400    
 H   -5.833600       1.295700       2.419500    
 H   -6.203200      0.4557000      0.8737000    
 H   -6.666700       2.153600       1.107000    


%chk=000162708-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162708

0 1
O 5.034791 -0.365294 -0.865110
O -3.738645 0.743036 0.858462
O -4.847484 -1.433288 -2.233558
O -4.170872 2.930924 0.166874
C 2.716671 0.241666 -0.311138
C 2.182884 -1.241203 -0.112210
C 0.749607 -1.318434 0.500845
C -0.181306 -0.235493 -0.119543
C 4.199680 0.178213 0.244197
C 1.871724 1.206964 0.563677
C 3.244337 -1.991015 0.759211
C 0.371966 1.195567 0.176495
C -1.653604 -0.402116 0.403264
C 4.127925 -0.884541 1.375291
C 0.173027 -2.746654 0.326990
C 2.666819 0.641678 -1.816808
C -1.284124 -2.871990 0.859666
C -2.126936 -1.828276 0.166326
C -2.629927 0.649641 -0.158827
C 3.153873 2.064183 -2.164960
C 4.782243 1.448795 0.714850
C -3.245980 0.268412 -1.512476
C -3.148473 -2.146369 -0.688990
C -3.847221 -1.140310 -1.511114
C 5.338264 2.464538 1.138283
C -4.455510 1.947413 0.887923
C -5.594554 1.859681 1.878936
H 2.129733 -1.715907 -1.112735
H 0.818876 -1.112072 1.593170
H -0.191610 -0.405607 -1.218023
H 2.262124 2.237407 0.486625
H 1.974494 0.922974 1.629237
H 3.865451 -2.643133 0.121058
H 2.779406 -2.624034 1.537057
H -0.202553 1.651009 1.007827
H 0.211836 1.846708 -0.703236
H -1.610066 -0.238692 1.502191
H 3.657836 -0.442425 2.272876
H 5.136360 -1.231262 1.665547
H 0.818470 -3.483014 0.842220
H 0.180687 -3.010615 -0.750157
H 1.623031 0.517536 -2.167423
H 3.276760 -0.089247 -2.376867
H -1.281969 -2.700948 1.955975
H -1.673001 -3.889481 0.676315
H -2.167751 1.649287 -0.222655
H 2.547698 2.848660 -1.675232
H 4.205222 2.206831 -1.862794
H 3.090817 2.229738 -3.256352
H 5.972934 -0.406928 -0.545833
H -2.449883 0.292837 -2.285419
H -4.011085 1.000106 -1.820658
H -3.476766 -3.185826 -0.813664
H 5.804091 3.365830 1.491970
H -5.290345 1.303256 2.779781
H -6.436912 1.312372 1.417615
H -5.935161 2.871110 2.145326


