%chk=000227198.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227198

0 1
 O    3.684200     -0.7967000       1.204200    
 O   -1.352000      -1.506400      0.4026000    
 O   -2.233300     -0.7755000      -1.598300    
 C    2.935400      -1.236500      5.8600001E-02
 C    2.926700     -7.0100002E-02 -0.9142000    
 C    1.549300      -1.676900      0.4876000    
 C    4.278900      0.5459000     -0.6569000    
 C    4.416400      0.3836000      0.8421000    
 C   0.6968000      -2.085900     -0.7101000    
 C   -2.764500      0.4082000      0.4436000    
 C   -2.285400       1.806800      1.4200000E-02
 C  -0.6810000      -2.569700     -0.2804000    
 C  -0.7741000       1.993200      0.1908000    
 C   -4.296800      0.3092000      0.3550000    
 C   -2.097800     -0.6798000     -0.3842000    
 C  -0.3371000       3.398200     -0.2253000    
 C   -4.832400      -1.024000      0.8614000    
 C    1.166800       3.576400     -9.0599999E-02
 H    3.482400      -2.083100     -0.3750000    
 H    2.790200     -0.3767000      -1.955000    
 H    2.141500      0.6477000     -0.6572000    
 H    1.066700     -0.8674000       1.050000    
 H    1.639300      -2.511900       1.193900    
 H    4.357900       1.586500     -0.9823000    
 H    5.055600     -3.4000002E-02  -1.169100    
 H    3.967500       1.229100       1.374300    
 H    5.457900      0.2838000       1.160200    
 H   0.5768000      -1.235900      -1.390700    
 H    1.198700      -2.885900      -1.266600    
 H   -2.478100      0.2627000       1.494200    
 H   -2.811100       2.567000      0.6054000    
 H   -2.548500       1.981100      -1.037000    
 H  -0.5926000      -3.405900      0.4214000    
 H   -1.261400      -2.932000      -1.136700    
 H  -0.4998000       1.815000       1.237500    
 H  -0.2338000       1.258200     -0.4159000    
 H   -4.624900      0.4495000     -0.6823000    
 H   -4.749400       1.114600      0.9460000    
 H  -0.8443000       4.141900      0.4003000    
 H  -0.6310000       3.592200      -1.263300    
 H   -5.926900      -1.021400      0.8385000    
 H   -4.515900      -1.206900       1.893200    
 H   -4.489100      -1.857700      0.2415000    
 H    1.701900       2.923000     -0.7851000    
 H    1.503300       3.352900      0.9266000    
 H    1.446200       4.609100     -0.3221000    


%chk=000227198-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227198

0 1
O 3.893268 -0.884942 1.007188
O -1.402492 -1.540599 0.549745
O -2.159103 -0.868462 -1.553008
C 3.004136 -1.319799 -0.116848
C 2.970363 -0.132639 -1.117684
C 1.636116 -1.726472 0.455161
C 4.270181 0.650579 -0.801680
C 4.370055 0.489129 0.727660
C 0.684452 -2.282690 -0.627569
C -2.800462 0.431198 0.452761
C -2.253846 1.807969 -0.021205
C -0.689839 -2.696265 -0.082757
C -0.759322 2.039623 0.294827
C -4.338119 0.335709 0.234298
C -2.108313 -0.693009 -0.311636
C -0.267302 3.439510 -0.137120
C -4.965571 -0.967202 0.772985
C 1.222540 3.683124 0.188111
H 3.495455 -2.202694 -0.577780
H 2.917716 -0.467298 -2.167382
H 2.086080 0.502245 -0.915376
H 1.177747 -0.848706 0.948596
H 1.796081 -2.488570 1.242801
H 4.222244 1.707558 -1.117435
H 5.137400 0.175008 -1.294899
H 3.722525 1.227428 1.247385
H 5.397436 0.567282 1.121910
H 0.535504 -1.545087 -1.437969
H 1.136983 -3.181777 -1.096392
H -2.574414 0.296266 1.527322
H -2.856514 2.599853 0.468140
H -2.424964 1.899720 -1.112360
H -0.602597 -3.423493 0.741597
H -1.328425 -3.098857 -0.889304
H -0.584331 1.907968 1.382883
H -0.146609 1.267280 -0.215048
H -4.545174 0.433791 -0.848979
H -4.804496 1.207429 0.734178
H -0.884965 4.212668 0.364252
H -0.436310 3.564837 -1.225912
H -6.061745 -0.962601 0.632476
H -4.760761 -1.094071 1.852420
H -4.566282 -1.854162 0.247488
H 1.867406 2.947868 -0.330776
H 1.412017 3.587668 1.274126
H 1.545451 4.693185 -0.124391


