%chk=000038022.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038022

0 1
 O    4.555300      0.3793000       1.927200    
 O   -5.751000      0.2034000      0.4943000    
 C   0.2911000      0.1818000     -8.0799997E-02
 C  -0.2954000      -1.169500     -0.5711000    
 C   -1.781900      -1.342100     -0.1859000    
 C    1.809600      0.3494000     -0.4702000    
 C   -2.681900     -0.1366000     -0.6099000    
 C    2.581000     -0.8883000      8.8900000E-02
 C  -0.6017000       1.382900     -0.4689000    
 C   -1.868500       1.011600      -1.238200    
 C   0.5505000      -2.364400     -0.1006000    
 C   -3.377600      0.3031000      0.7085000    
 C   -2.048800      -1.559400       1.314600    
 C    2.028200      -2.211700     -0.4527000    
 C    2.406300       1.615100      0.2086000    
 C   -3.424900     -0.9637000       1.550000    
 C    4.103200     -0.7900000     -0.1184000    
 C    1.969200      0.4812000      -2.008000    
 C    4.683900      0.4898000      0.5050000    
 C   -3.699200     -0.6254000      -1.667000    
 C    3.926300       1.741400      3.9200000E-02
 C   -4.739300      0.9019000      0.5352000    
 C    6.175100      0.6098000      0.1840000    
 C   -4.809500       2.400300      0.4162000    
 H   0.2750000      0.1518000       1.018500    
 H  -0.2653000      -1.178900      -1.668600    
 H   -2.137800      -2.249400     -0.6958000    
 H    2.417700     -0.9122000       1.177500    
 H  -5.9099998E-02   2.122100      -1.065200    
 H  -0.8787000       1.917300      0.4485000    
 H   -2.489300       1.906100      -1.356300    
 H   -1.566700      0.7299000      -2.256600    
 H   0.1681000      -3.289400     -0.5486000    
 H   0.4661000      -2.484500      0.9862000    
 H   -2.760000       1.026400       1.254700    
 H   -1.316000      -1.039700       1.940200    
 H   -2.018900      -2.620200       1.583800    
 H    2.581000      -3.052500     -1.6000001E-02
 H    2.166800      -2.281500      -1.537300    
 H    2.172900       1.598600       1.281400    
 H    1.944000       2.525600     -0.1893000    
 H   -4.201500      -1.660600       1.213600    
 H   -3.603900     -0.7523000       2.609200    
 H    4.572800      -1.667100      0.3471000    
 H    4.345300     -0.8394000      -1.186400    
 H    3.017500      0.5240000      -2.316200    
 H    1.521500     -0.3547000      -2.551200    
 H    1.501000       1.396100      -2.384400    
 H   -3.181900      -1.038500      -2.541300    
 H   -4.348600      -1.414200      -1.271900    
 H   -4.334100      0.1921000      -2.025900    
 H    4.162800       1.960200      -1.008500    
 H    4.257400       2.609700      0.6236000    
 H    6.610000       1.483600      0.6824000    
 H    6.727300     -0.2632000      0.5505000    
 H    6.349900      0.7017000     -0.8929000    
 H    5.049800     -0.4067000       2.215700    
 H   -4.214100       2.869400       1.203400    
 H   -4.455000       2.714400     -0.5668000    
 H   -5.847500       2.724300      0.5359000    


%chk=000038022-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000038022

0 1
O 4.764556 0.224619 1.825257
O -5.934928 -0.079996 0.217746
C 0.368526 0.162012 0.145981
C -0.286498 -1.139425 -0.408201
C -1.774626 -1.265991 0.007111
C 1.841595 0.345938 -0.383430
C -2.657619 -0.075250 -0.561772
C 2.648002 -0.941521 0.023471
C -0.571829 1.396994 -0.075450
C -1.755998 1.106179 -1.026612
C 0.548800 -2.382634 -0.021801
C -3.575455 0.350351 0.680105
C -2.064023 -1.341998 1.531380
C 2.010207 -2.246148 -0.505149
C 2.518555 1.542593 0.358428
C -3.524542 -0.858391 1.645360
C 4.146014 -0.830310 -0.336034
C 1.852557 0.596864 -1.915696
C 4.826173 0.387715 0.341248
C -3.493528 -0.580366 -1.764613
C 4.030752 1.683546 0.067472
C -4.996191 0.761317 0.289494
C 6.300417 0.525835 -0.085902
C -5.239037 2.236019 -0.012929
H 0.481111 0.017897 1.242983
H -0.279121 -1.083285 -1.518854
H -2.162099 -2.204417 -0.443613
H 2.594782 -0.983388 1.134387
H -0.001417 2.257571 -0.472787
H -0.969607 1.734159 0.902524
H -2.372761 2.020976 -1.141333
H -1.365733 0.875397 -2.037999
H 0.083800 -3.294819 -0.447935
H 0.539626 -2.503919 1.081354
H -3.087840 1.222000 1.162286
H -1.398257 -0.662444 2.098430
H -1.918817 -2.358837 1.938077
H 2.606873 -3.113506 -0.156033
H 2.043655 -2.271297 -1.614084
H 2.387978 1.396981 1.448873
H 2.018918 2.495007 0.094194
H -4.231681 -1.632068 1.293024
H -3.816996 -0.585217 2.675382
H 4.670601 -1.758502 -0.022349
H 4.278008 -0.757054 -1.434088
H 2.869000 0.803474 -2.294011
H 1.462660 -0.264682 -2.486000
H 1.228181 1.474213 -2.168116
H -2.824142 -1.037126 -2.518642
H -4.234404 -1.339329 -1.456803
H -4.043648 0.241422 -2.263020
H 4.199259 1.979296 -0.985978
H 4.456342 2.485574 0.699790
H 6.773614 1.369143 0.447740
H 6.870034 -0.395071 0.147907
H 6.388818 0.706047 -1.173289
H 5.262216 -0.599396 2.064858
H -5.082876 2.839108 0.902619
H -4.513677 2.605918 -0.762600
H -6.265782 2.390422 -0.379357


