%chk=000226752.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226752

0 1
 O   -2.823600      0.1348000      -1.008000    
 O    2.839700     -6.9399998E-02   1.036100    
 O   -2.163900     -0.1347000       1.221400    
 O    2.169900      0.4781000      -1.138700    
 C  -0.5168000      0.2457000     -0.5078000    
 C   0.5240000      6.7500003E-02  0.5848000    
 C   -4.885200       1.057400     -0.2060000    
 C    4.793500      -1.110100      0.1176000    
 C   -4.145600     -3.8699999E-02 -0.5927000    
 C    4.164700      1.5300000E-02  0.6032000    
 C   -6.750900     -0.4170000      0.2209000    
 C    6.779300      0.2180000     -0.2428000    
 C   -6.204100      0.8661000      0.2059000    
 C    6.117100      -1.007800     -0.3107000    
 C   -4.660100      -1.317600     -0.5878000    
 C    4.794500       1.239000      0.6818000    
 C   -5.979100      -1.508800     -0.1759000    
 C    6.118200       1.341400      0.2534000    
 C   -1.910800      4.6000000E-02  3.7000000E-02
 C    1.921000      0.1816000      2.3100000E-02
 C   -4.315500       2.437300     -0.2146000    
 C    4.100400      -2.430100      3.9099999E-02
 C   -8.161000     -0.6219000      0.6612000    
 C    8.194300      0.3279000     -0.7007000    
 H  -0.4529000       1.253200     -0.9341000    
 H  -0.3532000     -0.4867000      -1.306800    
 H   0.3983000      0.8327000       1.359100    
 H   0.4206000     -0.9217000       1.045900    
 H   -6.807900       1.714400      0.5196000    
 H    6.635100      -1.880700     -0.7013000    
 H   -4.060000      -2.167700     -0.8970000    
 H    4.280600       2.113600       1.068300    
 H   -6.392900      -2.513700     -0.1672000    
 H    6.622300       2.302500      0.3098000    
 H   -3.797600       2.637900      -1.158400    
 H   -5.096500       3.198500     -0.1116000    
 H   -3.611700       2.562100      0.6144000    
 H    4.805000      -3.247400     -0.1490000    
 H    3.591700      -2.657900      0.9817000    
 H    3.366200      -2.425000     -0.7728000    
 H   -8.787100      0.2343000      0.3878000    
 H   -8.601100      -1.504900      0.1854000    
 H   -8.200000     -0.7538000       1.747000    
 H    8.743700     -0.5998000     -0.5075000    
 H    8.226300      0.5387000      -1.774200    
 H    8.722000       1.128400     -0.1710000    


%chk=000226752-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226752

0 1
O -2.940759 -0.619932 -0.541689
O 2.942014 -0.267405 0.907972
O -2.150548 0.605917 1.296370
O 2.095628 0.477015 -1.149991
C -0.572104 -0.340126 -0.356445
C 0.563395 -0.196689 0.671919
C -4.941558 0.840910 -0.333659
C 4.948361 -0.879438 -0.425112
C -4.326668 -0.427077 -0.191417
C 4.315638 -0.044141 0.527399
C -7.088291 -0.217270 0.346529
C 7.056772 0.370397 0.003141
C -6.329628 0.910634 -0.056347
C 6.325486 -0.644578 -0.664086
C -5.046415 -1.573396 0.188955
C 5.008755 0.961442 1.224012
C -6.427234 -1.466707 0.457789
C 6.379288 1.167479 0.960345
C -1.929403 -0.049749 0.258518
C 1.905405 0.045388 0.004762
C -4.161566 2.064642 -0.768398
C 4.197898 -1.978159 -1.149718
C -8.567632 -0.085524 0.665961
C 8.523798 0.607162 -0.312496
H -0.407705 0.377622 -1.184796
H -0.589040 -1.339558 -0.822992
H 0.349090 0.664549 1.335561
H 0.637855 -1.074726 1.335434
H -6.832368 1.880431 -0.162482
H 6.841161 -1.280047 -1.395379
H -4.524243 -2.532274 0.264665
H 4.475068 1.564255 1.965411
H -6.991724 -2.358264 0.754289
H 6.922926 1.950256 1.501779
H -3.501671 1.840472 -1.626535
H -4.841825 2.881649 -1.061477
H -3.519383 2.429745 0.054526
H 4.897307 -2.675060 -1.641177
H 3.561969 -2.557794 -0.455678
H 3.535047 -1.551352 -1.925096
H -9.047831 0.696732 0.051913
H -9.105529 -1.034024 0.492640
H -8.721597 0.190544 1.727358
H 9.033454 -0.328791 -0.602003
H 8.638871 1.316935 -1.154773
H 9.060434 1.034904 0.552401


