%chk=000187313.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187313

0 1
O -3.041852 2.017398 0.769987
O -5.661371 0.496106 -0.293791
O -4.330077 -2.021314 0.250900
O 2.403880 -3.533876 0.512966
C -3.564798 1.580315 -0.522238
C -2.077500 1.559482 -0.235795
C -4.283941 0.244425 -0.583950
C -1.397063 0.267778 0.068551
C -3.663574 -0.768320 0.411572
C -2.162827 -0.859336 0.252507
C 0.056325 0.181854 0.078029
C 0.638532 -1.123240 -0.072593
C -1.545990 -2.155042 0.318301
C 0.919444 1.285159 0.266320
C -0.211741 -2.283426 0.101253
C 2.016746 -1.266225 -0.321232
C 2.306063 1.148545 0.008643
C 2.852615 -0.129732 -0.328186
C 0.410490 2.581335 0.810832
C 2.594729 -2.633353 -0.590772
C 3.203330 2.280821 0.066173
C 4.263463 -0.216697 -0.633001
C 4.529228 2.157743 -0.223005
C 5.070581 0.879385 -0.585323
H -4.036854 2.387091 -1.091503
H -1.459881 2.362387 -0.656909
H -4.250284 -0.149275 -1.629658
H -3.919649 -0.493760 1.469999
H -2.179331 -3.019575 0.530531
H -6.055134 -0.274893 0.181457
H 0.262510 -3.272867 0.103014
H -4.128201 -2.425254 -0.621198
H 0.042629 3.248976 0.017020
H -0.414484 2.429900 1.528913
H 1.182656 3.137116 1.364321
H 2.073308 -3.146911 -1.424208
H 3.681049 -2.604020 -0.817028
H 2.787837 3.252093 0.342080
H 4.667774 -1.195479 -0.904871
H 5.199706 3.014624 -0.187395
H 6.133056 0.812089 -0.816925
H 2.672000 -3.104325 1.352213


%chk=000187313-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187313

0 1
O -3.119052 2.055137 0.901837
O -5.740860 0.488006 -0.249691
O -4.430503 -2.049466 0.190016
O 2.601215 -3.535938 0.676031
C -3.594903 1.599786 -0.455581
C -2.123653 1.568202 -0.168400
C -4.326296 0.284724 -0.546589
C -1.419796 0.275611 0.091409
C -3.714314 -0.772230 0.399207
C -2.200897 -0.883616 0.254620
C 0.038003 0.184712 0.081335
C 0.631707 -1.143235 -0.077130
C -1.578337 -2.171026 0.308913
C 0.912638 1.309900 0.246320
C -0.214727 -2.299565 0.085609
C 2.030307 -1.304123 -0.327319
C 2.312370 1.153256 -0.018247
C 2.875194 -0.152663 -0.360392
C 0.436332 2.636039 0.832061
C 2.580148 -2.703324 -0.553861
C 3.203900 2.288724 0.029929
C 4.289201 -0.228336 -0.652405
C 4.558459 2.171760 -0.259615
C 5.108320 0.893679 -0.605303
H -4.000532 2.411231 -1.072236
H -1.528971 2.376787 -0.598763
H -4.205746 -0.086028 -1.595300
H -3.979703 -0.494673 1.434517
H -2.197912 -3.051597 0.504954
H -6.133806 -0.411192 -0.088193
H 0.243122 -3.291561 0.092234
H -4.171587 -2.417293 -0.695585
H 0.351932 3.442440 0.076916
H -0.533407 2.544027 1.340658
H 1.157593 2.984375 1.592481
H 1.934435 -3.275883 -1.239679
H 3.588916 -2.679150 -0.999877
H 2.799182 3.274629 0.272720
H 4.736915 -1.189322 -0.919430
H 5.206813 3.054149 -0.231733
H 6.175973 0.803981 -0.833381
H 3.025728 -3.013232 1.402946


