%chk=000242196.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242196

0 1
O 0.476815 2.064603 1.617519
O 1.820965 0.162180 2.740901
O 3.207518 2.172269 1.458506
O 2.707241 0.015837 -1.316104
O 5.087225 0.007598 -1.955331
O -0.239582 -5.160904 -1.073479
O -4.933676 3.152386 -1.400711
C 0.619886 0.912490 0.753909
C -0.711645 0.133306 0.890916
C 1.850819 0.152778 1.309314
C 3.191611 0.829130 0.924738
C 3.383514 1.043827 -0.593285
C -0.577640 -1.281779 0.372537
C -1.839256 0.898079 0.222225
C 4.874262 1.058262 -1.006703
C -1.145859 -2.333179 1.106293
C -2.214783 2.143651 0.769084
C 0.091033 -1.561544 -0.835139
C -2.525972 0.407380 -0.894036
C -1.055519 -3.652946 0.656076
C -3.249749 2.887797 0.216379
C 0.196444 -2.865954 -1.305742
C -3.573340 1.134289 -1.471173
C -0.383022 -3.898587 -0.547763
C -3.919014 2.365799 -0.904751
H 0.778822 1.251760 -0.292324
H -0.946053 0.090688 1.992883
H 1.861074 -0.924700 1.028924
H 4.029617 0.259185 1.385403
H 2.858312 1.976368 -0.912407
H 1.230612 2.694197 1.440111
H 5.176856 2.029221 -1.433086
H 5.563880 0.798320 -0.181258
H 1.231056 0.904738 3.059320
H -1.667885 -2.126008 2.041875
H -1.668889 2.534494 1.634703
H 0.543505 -0.746745 -1.410968
H -2.258572 -0.556127 -1.331879
H 3.259077 2.117796 2.444290
H 3.270363 -0.807512 -1.351138
H -1.496495 -4.461309 1.229537
H -3.549207 3.849764 0.624810
H 0.706946 -3.101852 -2.236550
H -4.099379 0.744227 -2.335255
H 4.633168 0.224533 -2.804407
H -0.660412 -5.850856 -0.504922
H -5.372673 2.740851 -2.183342


%chk=000242196-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242196

0 1
O 0.530694 2.172504 1.310798
O 1.938129 0.292402 2.650054
O 3.375428 2.236839 1.272731
O 2.980117 -0.139724 -1.554035
O 5.598900 0.160517 -1.063637
O -0.761964 -5.386999 -0.988900
O -5.125365 3.130640 -1.131865
C 0.681340 0.870659 0.610123
C -0.631275 0.085564 0.887592
C 1.961592 0.197329 1.173451
C 3.278444 0.865869 0.695919
C 3.406280 1.063535 -0.828819
C -0.606401 -1.365872 0.396501
C -1.836717 0.862818 0.326831
C 4.842442 1.422525 -1.233257
C -1.403421 -2.321763 1.074482
C -2.502168 1.825500 1.129052
C 0.125228 -1.797800 -0.742745
C -2.297598 0.664811 -0.997556
C -1.478997 -3.662380 0.643227
C -3.590857 2.569952 0.635072
C 0.061896 -3.135271 -1.186485
C -3.383729 1.406316 -1.512150
C -0.742249 -4.067739 -0.495604
C -4.030704 2.359585 -0.691151
H 0.780500 1.037636 -0.478608
H -0.740574 0.063006 1.991080
H 1.981758 -0.870827 0.912723
H 4.124593 0.256663 1.072383
H 2.729342 1.877455 -1.142890
H 1.382137 2.677896 1.160339
H 4.863202 1.747707 -2.292184
H 5.232989 2.221482 -0.575664
H 1.302655 1.040540 2.848104
H -1.979613 -2.011019 1.954414
H -2.147875 2.007477 2.149141
H 0.778946 -1.105061 -1.284873
H -1.821218 -0.090001 -1.632436
H 3.405538 2.106519 2.258314
H 3.778741 -0.735451 -1.582797
H -2.102060 -4.382727 1.189859
H -4.104056 3.312996 1.252650
H 0.629324 -3.469677 -2.060240
H -3.728083 1.233910 -2.540834
H 6.508894 0.249635 -1.435532
H -1.350458 -5.957934 -0.435305
H -5.351732 2.907759 -2.068775


