%chk=000187604.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187604

0 1
O 4.490010 1.514532 0.220175
O 3.746944 -0.398240 -1.482482
O -2.845749 2.153877 -0.926041
O -5.319019 0.720708 -0.004002
C 0.896425 0.600000 0.231835
C 0.985543 -0.849415 0.176371
C -1.564761 0.417013 0.094374
C -0.364244 1.236088 0.142503
C 3.396848 0.697841 0.636664
C 2.072727 1.386491 0.389833
C 3.497199 -0.666704 -0.092887
C 2.250613 -1.498838 0.074894
C -0.193397 -1.624413 0.207534
C -1.484896 -0.952259 0.197895
C -2.927078 1.082492 0.034209
C -4.077919 0.146604 -0.429921
C -0.405995 2.657963 0.140422
C 2.001383 2.767434 0.390022
C -2.705921 -1.765332 0.304688
C 2.331335 -2.879725 0.064922
C -0.081149 -3.042076 0.208581
C -3.918994 -1.263411 0.046850
C 0.750139 3.405155 0.248334
C 1.153404 -3.656079 0.148097
H 3.566078 0.585661 1.735981
H 4.427540 -1.202522 0.212220
H -3.166168 1.533285 1.028718
H -4.171655 0.177944 -1.548308
H -1.370466 3.166807 0.034900
H 2.912720 3.360345 0.503249
H -2.576442 -2.805408 0.618052
H 3.295773 -3.381543 -0.019097
H -0.988709 -3.647970 0.250776
H -4.837253 -1.842523 0.124768
H 0.706497 4.493895 0.234241
H 1.232438 -4.742913 0.151175
H 4.608602 1.439274 -0.764809
H 2.917209 -0.116540 -1.933739
H -3.745829 2.533619 -1.068949
H -5.466384 0.581479 0.954452


%chk=000187604-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187604

0 1
O 4.598784 1.515648 0.310661
O 3.810676 -0.369094 -1.537060
O -3.066234 2.314431 -0.702275
O -5.390175 0.777977 -0.224331
C 0.920486 0.609201 0.195346
C 1.007992 -0.845522 0.173503
C -1.571561 0.441273 0.047096
C -0.365481 1.258010 0.087009
C 3.436866 0.692700 0.647567
C 2.108520 1.393964 0.357827
C 3.531293 -0.655813 -0.092433
C 2.284272 -1.497280 0.080876
C -0.193552 -1.631105 0.201476
C -1.490132 -0.957065 0.195394
C -2.973281 1.066547 0.070656
C -4.077393 0.131601 -0.468200
C -0.397121 2.692896 0.077250
C 2.038514 2.793393 0.346331
C -2.723876 -1.751286 0.372362
C 2.363843 -2.897370 0.073592
C -0.072683 -3.057158 0.190860
C -3.963944 -1.255988 0.100277
C 0.781954 3.438723 0.192604
C 1.181094 -3.680389 0.139388
H 3.517764 0.510205 1.736902
H 4.437444 -1.192183 0.231026
H -3.216944 1.285812 1.142707
H -4.015351 0.116440 -1.574148
H -1.358679 3.193108 -0.041646
H 2.964167 3.364606 0.467802
H -2.632794 -2.777293 0.740479
H 3.343241 -3.382453 -0.005808
H -0.967671 -3.684972 0.190257
H -4.872644 -1.861183 0.193110
H 0.732653 4.533090 0.176591
H 1.248145 -4.773311 0.129293
H 4.744921 1.377814 -0.666656
H 2.953305 -0.143962 -1.984568
H -4.040962 2.503504 -0.781995
H -5.588056 0.725078 0.747381


