%chk=000239896.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239896

0 1
O -0.548519 0.147022 -0.977534
O -0.558490 -1.327806 0.836127
C -1.318203 -0.318209 0.138024
C 1.608898 -0.467898 0.029514
C -2.487566 -1.102756 -0.472608
C -1.716217 0.808214 1.103443
C 0.777610 0.625571 -0.683332
C 0.771905 -0.960679 1.240011
C -3.568979 -0.168757 -1.022262
C -2.802467 1.699166 0.492144
C 2.934199 0.120365 0.562543
C -4.004273 0.869490 0.020124
C 1.852150 -1.641092 -0.924871
C 3.838712 0.704760 -0.530739
C 5.153928 1.222343 0.048213
H -2.898057 -1.779302 0.302864
H -2.095838 -1.757223 -1.277502
H -0.836910 1.416969 1.378142
H -2.078057 0.347643 2.044117
H 0.704203 1.550815 -0.088457
H 1.160686 0.859390 -1.692589
H 1.154438 -1.909475 1.657156
H 0.705349 -0.205146 2.039795
H -4.439200 -0.762878 -1.357232
H -3.178533 0.348184 -1.923095
H -2.377325 2.259121 -0.365564
H -3.126923 2.455344 1.230268
H 3.486526 -0.673103 1.104650
H 2.722379 0.902627 1.316961
H -4.776531 1.534096 -0.409405
H -4.478260 0.364154 0.882906
H 2.382883 -1.331912 -1.830303
H 2.431143 -2.440328 -0.453721
H 0.885951 -2.068049 -1.238803
H 3.318161 1.526250 -1.059843
H 4.047733 -0.066675 -1.298924
H 4.988613 2.012076 0.789633
H 5.721483 0.424385 0.540624
H 5.793698 1.640201 -0.737575


%chk=000239896-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239896

0 1
O -0.618845 0.129949 -0.985066
O -0.549436 -1.441223 0.858233
C -1.352825 -0.403384 0.181342
C 1.608613 -0.479780 -0.002487
C -2.571687 -1.136534 -0.393403
C -1.769773 0.722610 1.160948
C 0.735914 0.619381 -0.667628
C 0.805166 -0.991261 1.227310
C -3.575317 -0.158561 -1.046134
C -2.770427 1.702041 0.500601
C 2.942263 0.133145 0.516807
C -4.003422 0.952452 -0.057688
C 1.849390 -1.651738 -0.983373
C 3.894728 0.706614 -0.560099
C 5.188809 1.278141 0.059858
H -3.052483 -1.686495 0.437785
H -2.207341 -1.881107 -1.122804
H -0.888677 1.274776 1.536775
H -2.240132 0.233409 2.036174
H 0.684648 1.513356 -0.007218
H 1.144161 0.928112 -1.644068
H 1.281109 -1.884104 1.668990
H 0.755003 -0.197890 2.004996
H -4.460273 -0.720457 -1.401223
H -3.100220 0.301546 -1.933419
H -2.262964 2.233562 -0.328236
H -3.082866 2.465723 1.238923
H 3.485706 -0.651291 1.086050
H 2.710429 0.939291 1.246850
H -4.686700 1.665678 -0.557962
H -4.568795 0.499708 0.783787
H 2.289374 -1.303324 -1.934963
H 2.536121 -2.397973 -0.540166
H 0.894354 -2.152516 -1.214504
H 3.383154 1.505563 -1.132498
H 4.156291 -0.084804 -1.288129
H 4.961879 2.093214 0.772911
H 5.742913 0.495436 0.611631
H 5.862459 1.685633 -0.716001


