%chk=000182423.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182423

0 1
O 0.836429 0.045045 0.751780
O -1.152427 -2.986364 -1.145197
O -0.915242 1.452061 1.024717
O 2.248830 1.677068 -0.097780
O 3.324204 1.254054 2.858891
O 4.117921 -1.653941 1.643714
O -5.303665 -0.266013 0.558142
O 4.799365 -0.851922 -1.020057
O -5.070211 1.627784 1.770066
O 3.811207 0.520353 -3.172626
C -1.187571 -0.824119 -0.040825
C -0.901389 -1.587105 -1.375368
C -2.707926 -0.530690 -0.114277
C -1.924414 -1.041409 -2.402123
C -3.001136 -0.281593 -1.614033
C -0.357225 0.446510 0.095959
C -3.131720 0.599392 0.771358
C 0.545445 -1.578515 -1.834924
C 1.795558 1.073218 1.096286
C -2.234141 1.467550 1.294148
C 2.816224 0.278550 1.941678
C 3.978431 -0.325703 1.126337
C 3.619093 -0.372937 -0.372675
C 3.301340 1.051513 -0.865791
C -4.548083 0.755117 1.107721
C 2.802121 1.079872 -2.320476
C -6.728966 -0.221951 0.836760
H -0.951090 -1.496047 0.822663
H -3.258585 -1.451098 0.215195
H -2.354111 -1.875922 -2.985324
H -1.439642 -0.387299 -3.144806
H -2.974547 0.797502 -1.845303
H -4.020951 -0.617773 -1.868827
H -0.147339 1.029484 -0.819977
H 0.811301 -0.680225 -2.409520
H 1.239680 -1.655807 -0.976324
H 0.742176 -2.456929 -2.470785
H 1.311717 1.921585 1.632523
H -2.082525 -3.152941 -0.898745
H -2.443442 2.294185 1.981420
H 2.289467 -0.539756 2.501508
H 4.933875 0.222868 1.297279
H 2.772627 -1.084254 -0.562444
H 4.184398 1.720249 -0.731153
H 2.540750 2.103339 -2.639406
H 1.925374 0.411887 -2.483342
H 3.760266 0.802551 3.617490
H 4.730616 -2.171548 1.065223
H 4.654248 -0.860901 -2.010610
H 4.543155 1.163408 -3.305156
H -7.104933 -1.092959 0.291288
H -7.150139 0.715188 0.458812
H -6.893496 -0.309314 1.915517


%chk=000182423-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000182423

0 1
O 0.899473 -0.349725 0.813662
O -1.787516 -3.252270 -0.963519
O -0.921339 0.918496 1.582915
O 2.109504 1.628306 0.077607
O 3.270939 0.615331 3.135660
O 5.205173 -0.972434 1.359859
O -5.446030 0.134863 0.160306
O 5.167885 -0.127654 -1.293323
O -5.057245 1.867301 1.680169
O 3.481269 0.853919 -3.343895
C -1.329917 -1.117411 0.181254
C -1.035553 -1.972225 -1.100719
C -2.779843 -0.599448 -0.098208
C -1.641890 -1.123747 -2.258394
C -2.797884 -0.277096 -1.635107
C -0.407025 0.085578 0.424392
C -3.195190 0.533126 0.815848
C 0.401238 -2.441153 -1.329973
C 1.840964 0.736486 1.199496
C -2.275431 1.167743 1.609753
C 3.054916 0.009194 1.819893
C 4.308251 0.103712 0.941645
C 3.918415 -0.022093 -0.533952
C 3.139541 1.248438 -0.929554
C -4.604225 0.939739 0.958785
C 2.456722 1.129094 -2.304380
C -6.887296 0.459290 0.249240
H -1.282094 -1.759506 1.078559
H -3.483907 -1.432900 0.094215
H -1.980672 -1.791468 -3.069544
H -0.863399 -0.464713 -2.687470
H -2.629715 0.802910 -1.794857
H -3.785059 -0.512304 -2.065329
H -0.363492 0.794914 -0.428084
H 1.090676 -1.591193 -1.447567
H 0.748114 -3.046851 -0.476824
H 0.436930 -3.065669 -2.239401
H 1.361427 1.383816 1.948235
H -2.759051 -3.060028 -0.922234
H -2.550084 1.924524 2.350438
H 2.799292 -1.064810 1.915951
H 4.797316 1.090010 1.096527
H 3.294236 -0.928179 -0.687295
H 3.860263 2.091575 -0.946912
H 1.885326 2.047952 -2.534926
H 1.775446 0.263469 -2.332344
H 4.023920 0.137771 3.568330
H 5.906208 -1.054125 0.660849
H 4.921953 -0.075058 -2.259879
H 3.852397 1.707374 -3.679893
H -7.378425 -0.244935 -0.437534
H -7.066007 1.504026 -0.056537
H -7.248601 0.323333 1.282668


