%chk=000146101.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000146101

0 1
O 4.205234 0.407902 0.183038
O 2.018850 2.207666 -0.071206
O -0.523679 2.484901 -0.133775
O -1.267429 -2.852582 0.069740
O 3.703515 -2.241639 0.163574
C 0.451350 0.354419 -0.014308
C 0.280719 -1.052427 0.041821
C -2.064542 0.687708 -0.060854
C -2.260032 -0.704807 -0.006219
C -0.691673 1.263687 -0.073742
C -1.103498 -1.651319 0.038384
C 1.763668 0.892377 -0.004163
C 1.359249 -1.912303 0.098292
C 2.882714 0.018323 0.053059
C 2.668602 -1.367925 0.099308
C -3.167914 1.546988 -0.102236
C -3.558575 -1.224407 0.006526
C -4.466386 1.020827 -0.088888
C -4.660933 -0.360177 -0.034636
C 4.667542 1.334894 -0.839966
H 1.226457 -2.998325 0.140614
H -3.003859 2.628722 -0.144648
H -3.702091 -2.309170 0.048821
H -5.323504 1.694641 -0.120843
H -5.671153 -0.771660 -0.024017
H 1.135519 2.783883 -0.106142
H 4.586000 -1.744668 0.165935
H 5.716271 1.475447 -0.555309
H 4.107574 2.275973 -0.765434
H 4.569504 0.887351 -1.830626


%chk=000146101-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000146101

0 1
O 4.248932 0.297663 -0.000013
O 1.990253 2.202873 -0.141501
O -0.480765 2.514554 -0.181245
O -1.327595 -2.939029 0.179327
O 3.748844 -2.296934 0.171888
C 0.448471 0.304915 -0.049550
C 0.249835 -1.111858 0.055963
C -2.056840 0.683695 -0.076669
C -2.275791 -0.723200 0.017524
C -0.678722 1.225987 -0.107849
C -1.128375 -1.684702 0.091014
C 1.783914 0.846145 -0.077363
C 1.353691 -1.977315 0.130910
C 2.890090 -0.043018 -0.027254
C 2.660235 -1.442949 0.092785
C -3.161113 1.568837 -0.139855
C -3.599744 -1.222575 0.046101
C -4.475699 1.060947 -0.111232
C -4.695309 -0.336963 -0.018259
C 4.733719 1.464844 -0.778581
H 1.199764 -3.056060 0.212037
H -2.962664 2.642522 -0.210268
H -3.740449 -2.305524 0.120009
H -5.328281 1.746439 -0.160730
H -5.717689 -0.728892 0.003986
H 1.029636 2.642413 -0.169797
H 4.578583 -1.743551 0.137966
H 5.817205 1.491022 -0.591253
H 4.241729 2.384460 -0.431823
H 4.531632 1.309554 -1.854166


