%chk=000184020.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184020

0 1
O -1.806892 0.030118 -1.117995
O 1.270704 -0.722055 1.378612
O 2.461035 -0.121045 1.878639
O 0.596598 -0.783924 -0.786138
C -0.508159 0.790881 0.766063
C -1.389185 1.235735 -0.418852
C 0.797969 0.125605 0.270136
C -2.685985 1.958231 -0.020309
C -3.199013 -0.312668 -0.821112
C 1.994052 1.003266 -0.138619
C -3.768763 0.871882 -0.002124
C 3.143740 0.483457 0.736052
C -0.190628 1.930677 1.730031
C 4.037228 -0.566186 0.039278
C -3.849470 -0.483869 -2.191829
C -3.252466 -1.608561 -0.042396
C 4.823393 0.070536 -1.109320
C 4.977192 -1.202827 1.066353
C -2.211452 -2.405917 0.172068
H -1.071302 -0.001183 1.332884
H -0.800659 1.783121 -1.184078
H -2.929292 2.743925 -0.758095
H -2.605246 2.466864 0.955401
H 1.802059 2.075076 0.020317
H 2.197050 0.874054 -1.221662
H -3.996555 0.565992 1.034901
H -4.717626 1.238832 -0.426643
H 3.735936 1.284982 1.222075
H 0.185867 2.822074 1.218112
H -1.072146 2.223245 2.311833
H 0.580627 1.609470 2.451493
H 3.362285 -1.364037 -0.370134
H -3.311000 -1.240615 -2.779893
H -4.894831 -0.795772 -2.118511
H -3.802320 0.448161 -2.768078
H -4.250466 -1.856275 0.324061
H -0.357162 -1.115687 -0.845554
H 4.157556 0.468669 -1.883198
H 5.471547 -0.670222 -1.592900
H 5.466486 0.886668 -0.764655
H 4.403143 -1.584057 1.924258
H 5.521913 -2.048324 0.634375
H 5.715616 -0.492971 1.450200
H -2.268831 -3.333270 0.724486
H -1.207047 -2.189357 -0.192834


%chk=000184020-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000184020

0 1
O -1.648922 -0.081067 -1.076724
O 1.342852 -0.353413 1.829917
O 2.763607 0.185544 2.138297
O 0.786983 -0.760282 -0.453414
C -0.494572 0.922345 0.885223
C -1.320335 1.223593 -0.398173
C 0.895380 0.282940 0.541915
C -2.700690 1.880485 -0.183059
C -3.104083 -0.425114 -0.906785
C 2.061021 1.226443 0.146552
C -3.643584 0.678461 0.058961
C 3.297354 0.567276 0.798300
C -0.339753 2.154177 1.805118
C 3.925714 -0.634274 0.053201
C -3.750041 -0.347798 -2.309472
C -3.267686 -1.819544 -0.322936
C 4.513090 -0.189548 -1.307872
C 5.014085 -1.287497 0.935381
C -2.298743 -2.631892 0.162477
H -1.037222 0.136212 1.448933
H -0.702766 1.791738 -1.118724
H -2.997161 2.423804 -1.098475
H -2.706388 2.598756 0.651420
H 1.922030 2.231279 0.576247
H 2.129255 1.298454 -0.948663
H -3.573517 0.330588 1.104551
H -4.698902 0.919086 -0.153253
H 4.078685 1.315214 1.047476
H -0.055566 3.063875 1.243071
H -1.280942 2.370012 2.339940
H 0.434918 1.953108 2.564958
H 3.118566 -1.366871 -0.131549
H -3.207892 -1.007766 -3.007255
H -4.807061 -0.669719 -2.274550
H -3.709264 0.682928 -2.703884
H -4.314138 -2.162448 -0.308762
H -0.169850 -0.820446 -0.774127
H 3.731816 0.175766 -1.998016
H 5.015030 -1.042301 -1.800302
H 5.267740 0.612031 -1.179316
H 4.600857 -1.572080 1.918056
H 5.416254 -2.194970 0.448792
H 5.859865 -0.591124 1.104526
H -2.550961 -3.618196 0.567683
H -1.239565 -2.355065 0.171016


