%chk=000227208.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227208

0 1
 O  -0.6655000       2.100900       1.129300    
 O    3.842800      2.3399999E-02  0.3694000    
 O    4.032400      -1.634600      -1.227100    
 C  -0.3689000       3.096300      0.1355000    
 C   -1.703700       3.512600     -0.4579000    
 C   0.5978000       2.531000     -0.8868000    
 C   -2.614700       3.392200      0.7379000    
 C   -2.069200       2.157600       1.423800    
 C    1.908700       2.091900     -0.2350000    
 C    2.866300       1.492100      -1.262300    
 C  -0.3380000      -2.650200      0.3416000    
 C   -1.491200      -1.659000      0.1674000    
 C   0.9828000      -1.925900      0.6078000    
 C    4.157900       1.013600     -0.6145000    
 C   -2.804900      -2.385000     -0.1307000    
 C    2.140500      -2.914200      0.7482000    
 C   -3.988900      -1.437900     -0.3451000    
 C    3.450500      -2.194900       1.046500    
 C   -5.296400      -2.162300     -0.6676000    
 C    3.815500      -1.263700     -8.0700003E-02
 C   -6.453800      -1.184000     -0.7998000    
 H   8.6999997E-02   3.946500      0.6585000    
 H   -1.682700       4.517200     -0.8891000    
 H   -2.025700       2.810500      -1.236700    
 H   0.7982000       3.278100      -1.663700    
 H   0.1459000       1.658700      -1.376200    
 H   -3.672900       3.303900      0.4786000    
 H   -2.492300       4.266600       1.388100    
 H   -2.531500       1.250100       1.023300    
 H   -2.218700       2.177200       2.506800    
 H    1.699100       1.355500      0.5490000    
 H    2.384000       2.952400      0.2515000    
 H    2.372100      0.6508000      -1.762700    
 H    3.102400       2.237600      -2.030200    
 H  -0.2428000      -3.263600     -0.5627000    
 H  -0.5594000      -3.330700       1.172700    
 H   -1.601900      -1.062600       1.080500    
 H   -1.262700     -0.9639000     -0.6495000    
 H    1.173400      -1.230200     -0.2174000    
 H   0.8942000      -1.326400       1.522100    
 H   -3.036800      -3.068100      0.6958000    
 H   -2.679300      -3.004600      -1.027400    
 H    4.862100      0.6327000      -1.363100    
 H    4.656400       1.841000     -9.7999997E-02
 H    2.236800      -3.500600     -0.1737000    
 H    1.929100      -3.620500       1.559600    
 H   -3.751100     -0.7419000      -1.159200    
 H   -4.124700     -0.8315000      0.5591000    
 H    4.269300      -2.912300       1.168500    
 H    3.373300      -1.637800       1.987300    
 H   -5.187500      -2.726300      -1.601000    
 H   -5.525500      -2.884700      0.1242000    
 H   -6.608000     -0.6300000      0.1317000    
 H   -7.378700      -1.720800      -1.032700    
 H   -6.268000     -0.4629000      -1.602100    


%chk=000227208-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227208

0 1
O -0.739188 2.125850 0.933717
O 4.051314 0.012813 0.477391
O 4.032826 -1.528755 -1.275558
C -0.251084 3.265827 0.089847
C -1.513872 3.857224 -0.582368
C 0.821508 2.756708 -0.884799
C -2.646819 3.509869 0.415241
C -2.222375 2.109253 0.901478
C 2.080803 2.217660 -0.173269
C 3.119243 1.651455 -1.165950
C -0.400316 -2.756317 0.296303
C -1.618499 -1.807514 0.239026
C 0.920855 -2.024893 0.621474
C 4.385493 1.102081 -0.493256
C -2.945190 -2.532751 -0.079086
C 2.138311 -2.975605 0.652266
C -4.164097 -1.584206 -0.134748
C 3.467893 -2.261925 1.015331
C -5.493020 -2.310120 -0.445745
C 3.875409 -1.267494 -0.059028
C -6.706114 -1.356036 -0.492919
H 0.197777 4.004442 0.788516
H -1.419302 4.941174 -0.765450
H -1.692729 3.356299 -1.553416
H 1.100594 3.587377 -1.567767
H 0.372643 1.958889 -1.510568
H -3.647311 3.512845 -0.050950
H -2.650431 4.226686 1.256750
H -2.567658 1.320980 0.200794
H -2.575585 1.866503 1.918804
H 1.778781 1.432843 0.543670
H 2.543927 3.031206 0.424136
H 2.665072 0.850602 -1.780125
H 3.438487 2.447542 -1.871290
H -0.297894 -3.282821 -0.675788
H -0.582815 -3.543171 1.058627
H -1.711789 -1.273218 1.207403
H -1.432921 -1.023458 -0.524930
H 1.087891 -1.229432 -0.133555
H 0.825613 -1.507341 1.598115
H -3.127420 -3.316240 0.686461
H -2.850271 -3.063904 -1.049523
H 5.091520 0.700013 -1.241807
H 4.879536 1.861671 0.135530
H 2.255975 -3.464765 -0.334057
H 1.960807 -3.779365 1.394195
H -3.986796 -0.802763 -0.904335
H -4.258110 -1.050252 0.834706
H 4.275484 -3.015015 1.096832
H 3.385213 -1.739206 1.983073
H -5.399047 -2.840622 -1.415365
H -5.666204 -3.093284 0.320492
H -6.840464 -0.838642 0.476008
H -7.642461 -1.899128 -0.718306
H -6.570094 -0.580271 -1.270427


