%chk=000185397.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185397

0 1
O 0.807490 0.419507 -1.001497
O 2.849812 -0.320117 -0.782859
O -2.045366 -2.308806 0.419450
O 0.188683 -1.997583 0.493471
O 1.842283 0.676678 1.052409
C -1.312935 -0.118126 0.090365
C -0.441496 0.814870 -0.497182
C -2.605018 0.322173 0.433353
C -0.812573 2.142223 -0.739994
C -2.992795 1.641613 0.198522
C -2.100184 2.548972 -0.387718
C -0.911436 -1.518887 0.346562
C 4.068607 -0.633284 -0.011787
C 1.850559 0.276145 -0.081222
C 4.833818 0.630047 0.304754
C -1.826438 -3.720804 0.683387
H -3.304384 -0.389122 0.884906
H -0.100491 2.828419 -1.197676
H -3.995576 1.968238 0.472751
H -2.410311 3.579873 -0.567576
H 3.772116 -1.201823 0.887622
H 4.576061 -1.289171 -0.745704
H 5.816077 0.405797 0.738962
H 4.998158 1.242606 -0.591848
H 4.291018 1.257283 1.030831
H -1.367360 -3.840836 1.669639
H -1.185687 -4.146645 -0.095933
H -2.841932 -4.128340 0.647913


%chk=000185397-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185397

0 1
O 0.825603 0.683726 -1.031790
O 2.866158 -0.168669 -0.853354
O -1.933919 -2.240268 0.700396
O 0.179430 -1.950929 -0.219279
O 1.662636 0.215625 1.128650
C -1.349454 -0.037259 -0.022259
C -0.488536 0.957797 -0.569262
C -2.668626 0.354496 0.338754
C -0.936308 2.277613 -0.774068
C -3.118722 1.674290 0.148356
C -2.251895 2.638571 -0.418268
C -0.922592 -1.458221 0.126227
C 4.029438 -0.679437 -0.059406
C 1.780318 0.212932 -0.110726
C 4.892921 0.475115 0.452947
C -1.596503 -3.670348 0.880654
H -3.330059 -0.404454 0.763440
H -0.240182 3.000836 -1.208388
H -4.138990 1.949558 0.433907
H -2.594568 3.666465 -0.577317
H 3.640216 -1.297403 0.768345
H 4.564692 -1.310503 -0.785696
H 5.795758 0.070578 0.947129
H 5.216891 1.123333 -0.379463
H 4.340977 1.082575 1.189648
H -0.723368 -3.774788 1.546480
H -1.365721 -4.135125 -0.092695
H -2.494897 -4.115207 1.330939


