%chk=000229367.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229367

0 1
O 0.513378 -3.545718 -1.006510
O -4.070742 1.802049 0.273688
C 0.572969 -1.440878 0.167932
C 1.569893 -0.980031 -0.916402
C -0.681652 -0.602448 0.157963
C 2.404639 0.175320 -0.437746
C 0.204714 -2.920165 -0.018518
C -0.908628 0.329541 1.188928
C -1.616506 -0.727418 -0.878029
C 1.878184 1.476666 -0.439071
C 3.715246 -0.039804 0.014941
C -0.552536 -3.541720 1.118266
C -2.053550 1.116283 1.193013
C -2.777476 0.050968 -0.896186
C -2.983893 0.966002 0.142863
C 2.656114 2.548434 0.004676
C 4.489925 1.036335 0.457044
C 3.963352 2.331535 0.453143
C -5.092646 1.748680 -0.750637
H 1.079920 -1.349469 1.165222
H 1.026955 -0.707816 -1.845495
H 2.211231 -1.837691 -1.217934
H -0.175905 0.443576 1.989072
H -1.440916 -1.440854 -1.686165
H 0.858362 1.647661 -0.782619
H 4.133191 -1.044353 0.019080
H -0.931070 -4.538368 0.846401
H -1.414406 -2.930576 1.421869
H 0.082485 -3.669647 2.004399
H -2.246665 1.842460 1.979510
H -3.490739 -0.062153 -1.705494
H 2.243125 3.555790 0.000303
H 5.507308 0.864249 0.804040
H 4.568155 3.167717 0.796057
H -5.551897 0.756563 -0.778623
H -4.674981 2.034119 -1.720292
H -5.806741 2.502459 -0.393290


%chk=000229367-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229367

0 1
O 0.196136 -3.544022 -1.232617
O -4.028096 1.907895 0.402917
C 0.587794 -1.567047 0.163713
C 1.638079 -1.118404 -0.903248
C -0.648021 -0.656969 0.207981
C 2.382084 0.140495 -0.486758
C 0.116467 -3.016109 -0.090950
C -0.900334 0.187374 1.320853
C -1.563838 -0.633840 -0.872302
C 1.897457 1.430608 -0.825117
C 3.574049 0.048072 0.279135
C -0.454098 -3.765521 1.105310
C -2.027571 1.028441 1.356039
C -2.701452 0.203440 -0.854771
C -2.934952 1.037926 0.267237
C 2.582725 2.594662 -0.409814
C 4.262942 1.208890 0.697514
C 3.768325 2.488727 0.353975
C -4.997178 1.954321 -0.694668
H 1.062333 -1.538445 1.165040
H 1.118741 -0.974086 -1.866872
H 2.349887 -1.951248 -1.055001
H -0.197712 0.196772 2.162550
H -1.394182 -1.283973 -1.739249
H 0.977225 1.519986 -1.414619
H 3.970919 -0.942260 0.538033
H -0.979656 -4.675236 0.775804
H -1.138072 -3.120432 1.685168
H 0.372095 -4.059210 1.782838
H -2.222962 1.687008 2.207748
H -3.389725 0.193310 -1.705254
H 2.193661 3.582334 -0.682765
H 5.185604 1.116562 1.282160
H 4.302455 3.390920 0.673043
H -5.475996 0.968150 -0.852052
H -4.523162 2.291045 -1.637304
H -5.753778 2.687161 -0.378298


