%chk=000251512.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251512

0 1
O 2.041907 -0.359615 0.509438
O 1.192069 -2.025798 -0.761910
C 4.300473 0.275882 0.673438
C 3.403284 -0.932370 0.399668
C 4.453221 1.168971 -0.564460
C 3.520213 -2.031674 1.442440
C 5.335585 2.381209 -0.279399
C 1.012180 -1.013553 -0.117551
C -0.245813 -0.282560 0.130983
C -2.691964 -0.026704 -0.206579
C -1.399539 -0.698673 -0.409589
C -2.781155 1.371979 -0.113253
C -3.860846 -0.804003 -0.116062
C -4.023868 1.983619 0.072848
C -5.098028 -0.186975 0.078080
C -5.182027 1.206795 0.171654
H 5.292746 -0.066762 1.024014
H 3.871225 0.865787 1.510653
H 3.512809 -1.333130 -0.632517
H 3.450271 1.502939 -0.901218
H 4.878421 0.585382 -1.404486
H 3.267289 -1.668294 2.445982
H 2.831511 -2.858698 1.214382
H 4.531869 -2.449867 1.479826
H 5.436183 3.013852 -1.168838
H 6.344918 2.085501 0.028159
H 4.918637 3.005259 0.519620
H -0.159318 0.592262 0.779273
H -1.427364 -1.597979 -1.042857
H -1.882062 1.982018 -0.194733
H -3.801179 -1.889345 -0.190037
H -4.088490 3.068723 0.141558
H -6.000221 -0.792436 0.154668
H -6.148837 1.685259 0.319704


%chk=000251512-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251512

0 1
O 2.098982 -0.268658 0.654128
O 1.124290 -2.086743 -0.461668
C 4.471752 0.223502 0.562583
C 3.452250 -0.925162 0.560066
C 4.381338 1.138585 -0.678371
C 3.603804 -1.901562 1.734613
C 5.410322 2.288801 -0.640418
C 1.014343 -0.965141 0.102025
C -0.227491 -0.184450 0.279477
C -2.734854 -0.006429 -0.112639
C -1.419838 -0.655769 -0.198099
C -2.943133 1.256213 0.517056
C -3.858613 -0.667190 -0.688041
C -4.226968 1.831744 0.565449
C -5.144865 -0.090791 -0.639921
C -5.334417 1.162235 -0.012760
H 5.485502 -0.223077 0.622614
H 4.331277 0.823286 1.483919
H 3.475833 -1.478779 -0.398634
H 3.357595 1.553228 -0.743530
H 4.535072 0.530803 -1.593341
H 3.525450 -1.367378 2.698260
H 2.826974 -2.683408 1.694042
H 4.591389 -2.396454 1.689745
H 5.328353 2.932522 -1.535264
H 6.445411 1.899269 -0.598482
H 5.256434 2.927347 0.249990
H -0.125695 0.772070 0.801486
H -1.386866 -1.631478 -0.705838
H -2.098074 1.786954 0.968980
H -3.713056 -1.639171 -1.175173
H -4.370898 2.802555 1.052597
H -5.995824 -0.614564 -1.088749
H -6.331681 1.614088 0.026797


