%chk=000187337.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187337

0 1
O -2.298054 -2.268897 0.883776
O -5.093264 -1.306711 0.473932
C -2.680327 -1.192690 0.007412
C -1.489992 -0.248343 -0.017696
C -3.928996 -0.492061 0.637473
C -1.717353 1.148035 -0.210174
C -0.204245 -0.734275 0.106903
C 0.916410 0.135905 0.035135
C -2.959552 -1.754320 -1.386701
C 0.692468 1.516274 -0.179396
C -4.135550 0.891649 0.089506
C -0.634421 2.007264 -0.297328
C -3.098157 1.648903 -0.289298
C 2.280911 -0.355302 0.171640
C 3.358463 0.557011 0.073302
C 1.819650 2.419651 -0.273175
C 3.091166 1.961128 -0.154425
C 2.566753 -1.728096 0.403268
C 4.693000 0.086620 0.201488
C 3.869972 -2.167491 0.526394
C 4.944248 -1.252680 0.423582
H -3.816696 -0.465774 1.753444
H -0.049826 -1.805643 0.277769
H -2.081946 -2.299728 -1.761515
H -3.796008 -2.461150 -1.383105
H -3.178496 -0.956840 -2.105961
H -5.168309 1.232982 0.057309
H -0.788505 3.074890 -0.449257
H -3.230313 2.665845 -0.660248
H -3.059430 -2.875620 1.023596
H 1.612958 3.476030 -0.441480
H -5.394516 -1.305963 -0.459125
H 3.944007 2.636030 -0.225196
H 1.739079 -2.435261 0.487090
H 5.514562 0.797107 0.123116
H 4.083094 -3.220374 0.704913
H 5.965412 -1.616806 0.522733


%chk=000187337-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187337

0 1
O -2.362730 -2.419554 0.770983
O -5.129678 -1.401969 0.554286
C -2.707555 -1.215995 -0.007132
C -1.506853 -0.268914 0.014812
C -3.937041 -0.533705 0.662658
C -1.739954 1.133418 -0.215976
C -0.205537 -0.753028 0.149239
C 0.932560 0.108240 0.049771
C -3.006288 -1.632492 -1.474012
C 0.703599 1.506959 -0.222636
C -4.174074 0.866562 0.134321
C -0.633598 1.988426 -0.346501
C -3.122032 1.638901 -0.266535
C 2.306011 -0.373701 0.201508
C 3.399768 0.559061 0.057996
C 1.827145 2.406828 -0.356844
C 3.124192 1.949838 -0.224769
C 2.620344 -1.738531 0.489691
C 4.745773 0.099408 0.199875
C 3.947446 -2.167588 0.626219
C 5.022480 -1.243749 0.479414
H -3.749803 -0.507856 1.754316
H -0.086585 -1.821880 0.342673
H -2.103018 -2.095374 -1.903578
H -3.819659 -2.381388 -1.511814
H -3.285852 -0.764311 -2.097481
H -5.199232 1.254281 0.175046
H -0.794526 3.058913 -0.527851
H -3.281805 2.676682 -0.584292
H -3.207477 -2.927605 0.895269
H 1.627326 3.464511 -0.565676
H -5.482453 -1.338587 -0.370418
H 3.971203 2.638222 -0.328908
H 1.815389 -2.469129 0.612859
H 5.563709 0.821205 0.086977
H 4.159504 -3.219009 0.848996
H 6.057498 -1.585791 0.587216


