%chk=000225154.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225154

0 1
O -0.946830 1.925040 0.817656
O 2.122381 -1.931859 0.883132
C -1.544596 1.064641 -0.185521
C 1.667174 -1.176545 -0.267870
C -0.441291 0.182716 -0.812856
C 0.320209 -0.626724 0.235620
C -2.588425 0.296973 0.644973
C 2.709541 -0.089486 -0.608314
C -2.183391 1.959994 -1.255032
C 1.509546 -2.154954 -1.439144
C -3.341883 -0.773853 -0.148346
C 3.049784 0.797448 0.595544
C -4.391426 -1.471276 0.714776
C 4.197227 1.756114 0.290650
H -0.894764 -0.492736 -1.562847
H 0.262751 0.825959 -1.376540
H -0.295433 -1.474777 0.598922
H 0.498593 -0.005013 1.141734
H -3.299328 1.027556 1.081411
H -2.082039 -0.155442 1.522624
H 3.632517 -0.564498 -0.990818
H 2.332031 0.532345 -1.441940
H -2.850104 2.696133 -0.787145
H -1.439570 2.519941 -1.828178
H -2.782876 1.379685 -1.963507
H 1.084228 -1.668731 -2.321690
H 2.463590 -2.601312 -1.734146
H 0.842170 -2.980400 -1.160340
H -3.830186 -0.318432 -1.032343
H -2.628663 -1.524550 -0.543395
H 3.306405 0.156209 1.464859
H 2.152634 1.368438 0.908514
H -0.224202 2.456405 0.443815
H 3.006842 -2.305288 0.733890
H -3.937351 -1.961501 1.584122
H -4.925457 -2.240376 0.146124
H -5.138118 -0.764143 1.094052
H 3.963699 2.414627 -0.552967
H 4.415666 2.394770 1.154572
H 5.119445 1.219102 0.042050


%chk=000225154-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225154

0 1
O -0.933375 2.046972 0.811908
O 2.104817 -2.058244 0.886289
C -1.543749 1.122543 -0.192787
C 1.661704 -1.229641 -0.276170
C -0.421905 0.241236 -0.816160
C 0.308644 -0.655619 0.206194
C -2.564596 0.319814 0.647032
C 2.737226 -0.142166 -0.560154
C -2.228968 1.968871 -1.288366
C 1.491697 -2.152544 -1.504259
C -3.340519 -0.776859 -0.115887
C 2.990242 0.845473 0.599932
C -4.337424 -1.518992 0.801653
C 4.211192 1.754476 0.341868
H -0.859665 -0.372716 -1.627454
H 0.301000 0.928168 -1.305529
H -0.327676 -1.517776 0.482468
H 0.480640 -0.083543 1.135251
H -3.279852 1.043871 1.084815
H -2.025385 -0.134269 1.499532
H 3.689972 -0.661959 -0.803903
H 2.462103 0.419111 -1.476690
H -2.980870 2.639600 -0.836585
H -1.486742 2.592099 -1.825712
H -2.731466 1.334138 -2.040455
H 1.112463 -1.597297 -2.381539
H 2.459553 -2.607678 -1.793163
H 0.783108 -2.967339 -1.271743
H -3.893763 -0.331083 -0.966060
H -2.632317 -1.511064 -0.549425
H 3.136325 0.267363 1.532438
H 2.091211 1.471960 0.763643
H -0.318412 2.660861 0.332126
H 2.967647 -2.486542 0.647444
H -3.812309 -2.003992 1.645783
H -4.889451 -2.302644 0.250825
H -5.079522 -0.818318 1.228566
H 4.083549 2.347655 -0.584288
H 4.369900 2.462066 1.176340
H 5.135472 1.156207 0.228324


