%chk=000182985.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182985

0 1
I 7.276560 0.135254 0.002327
O 0.394602 0.602809 -1.159904
O 0.393027 0.611707 1.154568
O 0.408698 -1.397771 0.004912
C -1.647463 -0.077819 -0.001391
C -1.055378 0.628800 -1.247764
C -1.057059 0.636910 1.241140
C -1.040726 -1.501898 0.003333
C 0.891438 -0.057078 0.000179
C -3.154406 -0.029843 -0.001715
C 2.393375 -0.022240 0.000901
C -3.794960 1.222220 -0.014175
C -3.934425 -1.194371 0.010937
C 3.046587 1.217825 0.014333
C 3.125067 -1.217329 -0.012055
C -5.188576 1.304051 -0.014412
C -5.331022 -1.107947 0.010661
C -5.961703 0.138232 -0.002048
C 4.445107 1.263313 0.014782
C 4.523098 -1.172191 -0.011591
C 5.159282 0.067438 0.001771
H -1.301641 0.113287 -2.191242
H -1.318715 1.697258 -1.312433
H -1.321514 1.705468 1.298967
H -1.303687 0.126925 2.187521
H -1.284444 -2.075507 0.913845
H -1.282721 -2.080485 -0.904468
H -3.207297 2.139547 -0.023663
H -3.473652 -2.180383 0.021235
H 2.460967 2.139677 0.024673
H 2.599489 -2.176664 -0.022278
H -5.674586 2.279330 -0.024228
H -5.927432 -2.020025 0.020470
H -7.048587 0.202693 -0.002287
H 4.957403 2.226621 0.025231
H 5.096594 -2.100413 -0.021634


%chk=000182985-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000182985

0 1
I 7.389180 0.174364 -0.000724
O 0.439875 0.617913 -1.200602
O 0.437991 0.630189 1.194992
O 0.431386 -1.452670 0.007779
C -1.634479 -0.070048 -0.000883
C -1.050393 0.641311 -1.255663
C -1.052280 0.652735 1.248300
C -1.055817 -1.507324 0.005931
C 0.915557 -0.077114 0.001264
C -3.164123 -0.021108 -0.001790
C 2.425417 -0.053673 0.002207
C -3.827311 1.237155 -0.011072
C -3.958116 -1.197263 0.006994
C 3.078175 1.200003 0.014050
C 3.184971 -1.242670 -0.010627
C -5.235834 1.315706 -0.011497
C -5.369266 -1.120118 0.006541
C -6.014914 0.135664 -0.002636
C 4.487642 1.271607 0.013291
C 4.597366 -1.186292 -0.011431
C 5.234441 0.073080 0.000463
H -1.367004 0.125903 -2.181499
H -1.364421 1.699424 -1.303085
H -1.367469 1.710928 1.285929
H -1.369448 0.145234 2.178302
H -1.365602 -2.062204 0.911292
H -1.363817 -2.069838 -0.895365
H -3.246588 2.167122 -0.018079
H -3.487788 -2.185949 0.014175
H 2.485434 2.119159 0.024647
H 2.671787 -2.207563 -0.019695
H -5.725253 2.295919 -0.018755
H -5.962135 -2.041457 0.013390
H -7.108699 0.195501 -0.002948
H 4.988993 2.243138 0.022570
H 5.183840 -2.109361 -0.021266


