%chk=000188486.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188486

0 1
O 0.928093 -3.264858 -0.248954
O 1.698081 2.182597 0.417675
O 1.529689 2.736624 -1.788565
C -0.134823 -1.026145 -0.061403
C 0.122074 0.384447 0.071427
C 2.310841 -1.439339 -0.001018
C 2.556164 -0.055269 0.149029
C 0.937965 -1.898030 -0.116423
C 1.422309 0.825649 0.174032
C -1.551867 -1.446753 -0.113824
C -1.011962 1.339012 0.100336
C 3.414133 -2.342222 -0.036821
C 3.897384 0.411726 0.271608
C 4.701396 -1.871076 0.078489
C 4.944918 -0.478860 0.235797
C -2.272042 -1.357356 -1.315972
C -2.189067 -1.902169 1.051932
C -1.749162 1.519815 1.280006
C -1.345076 2.061445 -1.055483
C -3.615460 -1.738350 -1.351709
C -3.533259 -2.280678 1.007152
C -2.818400 2.419532 1.298496
C -2.417451 2.956131 -1.029441
C -4.246817 -2.203465 -0.193222
C -3.155000 3.136175 0.145504
C -0.271417 -3.959002 -0.666091
C 1.710830 3.079574 -0.650124
C 1.982037 4.430842 -0.089272
H 3.207283 -3.408203 -0.157256
H 4.061938 1.481723 0.397821
H 5.548315 -2.554507 0.051180
H 5.973462 -0.131653 0.327213
H -1.783171 -0.977183 -2.211930
H -1.634550 -1.952436 1.987369
H -1.488329 0.956866 2.174569
H -0.756702 1.928700 -1.966651
H -4.174285 -1.665753 -2.283466
H -4.027437 -2.631491 1.911635
H -3.391921 2.559470 2.212860
H -2.678632 3.513036 -1.927606
H -3.991082 3.831951 0.162090
H -5.293917 -2.496881 -0.224387
H -0.991914 -3.985211 0.157045
H 0.122311 -4.961614 -0.878309
H -0.695242 -3.503601 -1.565266
H 1.091667 5.073846 -0.189855
H 2.805677 4.922859 -0.628684
H 2.241519 4.399185 0.981967


%chk=000188486-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188486

0 1
O 0.590806 -3.292674 0.197022
O 1.659352 2.258312 0.251061
O 1.872096 2.574744 -2.064329
C -0.256457 -0.982192 0.093076
C 0.031707 0.439723 0.081031
C 2.185429 -1.463243 0.217085
C 2.473108 -0.048548 0.199804
C 0.815824 -1.893745 0.153196
C 1.367952 0.857202 0.121317
C -1.668470 -1.483367 0.051740
C -1.076888 1.452577 0.104929
C 3.268780 -2.397111 0.297133
C 3.835448 0.387633 0.274657
C 4.588776 -1.946230 0.356745
C 4.873181 -0.543773 0.347906
C -2.555266 -1.098570 -0.988977
C -2.142077 -2.367607 1.057727
C -1.916321 1.554963 1.244344
C -1.304168 2.320893 -0.994006
C -3.881408 -1.581635 -1.022212
C -3.469814 -2.846822 1.027596
C -2.955946 2.508869 1.287982
C -2.348393 3.272164 -0.952546
C -4.345843 -2.455782 -0.012337
C -3.176751 3.371765 0.189152
C 0.206897 -3.906612 -1.091775
C 1.890390 3.039366 -0.909229
C 2.121526 4.475834 -0.504151
H 3.029375 -3.463747 0.325794
H 4.050488 1.460059 0.284404
H 5.412818 -2.665164 0.419438
H 5.912402 -0.201924 0.403730
H -2.203416 -0.422477 -1.775208
H -1.462321 -2.680900 1.856175
H -1.751458 0.884706 2.095070
H -0.672862 2.237672 -1.885831
H -4.550626 -1.273350 -1.833247
H -3.820068 -3.524206 1.814712
H -3.594575 2.575945 2.175927
H -2.516442 3.929691 -1.813158
H -3.987260 4.108733 0.220809
H -5.376517 -2.827534 -0.035146
H -0.749942 -3.493794 -1.459732
H 0.094336 -4.981298 -0.882474
H 1.001621 -3.746938 -1.846032
H 1.165110 4.910618 -0.161170
H 2.495380 5.051203 -1.363168
H 2.829585 4.535669 0.338668


