%chk=000273499.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273499

0 1
O 0.382630 0.182625 0.017538
O -4.031340 2.264987 0.126673
O -3.639642 -2.340730 0.116724
O 0.554043 -2.190732 0.003643
O -1.311727 -3.461797 0.039244
C -0.974983 0.200064 0.049172
C -1.552631 -1.098809 0.064736
C 1.104830 1.461831 0.013178
C 2.557097 1.093005 0.139069
C -1.747751 1.365691 0.066388
C -2.983800 -1.172179 0.101402
C -3.148027 1.226528 0.104390
C -3.781437 -0.023713 0.123102
C 2.941218 -0.149347 0.659812
C 3.530270 2.025135 -0.252120
C -0.806147 -2.336267 0.037772
C 4.297666 -0.457717 0.792757
C 4.884417 1.711043 -0.112237
C 5.269960 0.471528 0.410249
C -3.516016 3.621527 0.110532
C 1.324188 -3.427395 -0.051744
H 0.764614 2.063047 0.877350
H 0.874308 1.971260 -0.939975
H -1.291645 2.343344 0.049428
H -4.865858 -0.104848 0.152194
H 2.169402 -0.874056 0.944126
H 3.238872 2.988932 -0.663513
H 4.596488 -1.422984 1.198075
H 5.641708 2.433373 -0.412905
H 6.326139 0.231184 0.517327
H -3.006842 -3.175362 0.094345
H -2.911139 3.806818 1.002568
H -4.443944 4.209629 0.134019
H -2.959155 3.803640 -0.812854
H 0.893438 -4.114645 -0.788565
H 1.328322 -3.880684 0.943487
H 2.314975 -3.072028 -0.353988


%chk=000273499-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000273499

0 1
O 0.416348 0.139160 0.127446
O -3.986417 2.345874 -0.011461
O -3.761868 -2.382031 0.096883
O 0.457859 -2.486804 0.194150
O -1.567579 -3.587124 0.171597
C -0.974942 0.118139 0.099703
C -1.605057 -1.174663 0.115971
C 1.107529 1.433839 0.110255
C 2.604781 1.176837 0.143446
C -1.734394 1.307204 0.057370
C -3.059886 -1.200803 0.085422
C -3.152728 1.226313 0.029884
C -3.814005 -0.013336 0.043229
C 3.132194 -0.135517 0.178660
C 3.487854 2.285767 0.138124
C -0.923624 -2.470583 0.160949
C 4.532564 -0.331689 0.208200
C 4.885085 2.086277 0.167640
C 5.412757 0.773992 0.202855
C -3.369824 3.675847 -0.026514
C 1.067984 -3.841759 0.242375
H 0.794519 2.033507 0.991433
H 0.827526 1.991955 -0.808566
H -1.237621 2.277517 0.045873
H -4.903568 -0.065796 0.021775
H 2.435008 -0.978121 0.182363
H 3.087551 3.307963 0.111008
H 4.937189 -1.350093 0.235336
H 5.559447 2.949951 0.163206
H 6.497030 0.617534 0.225709
H -3.075127 -3.152768 0.128607
H -2.772589 3.852927 0.888621
H -4.214460 4.379034 -0.057904
H -2.736375 3.815688 -0.923548
H 0.788464 -4.419942 -0.653547
H 0.730892 -4.382183 1.141960
H 2.149982 -3.650214 0.272891


