%chk=000219467.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219467

0 1
O -2.675332 -1.588265 -1.022042
O 0.010778 -3.143070 0.846119
O 2.568538 2.333869 -1.159826
O -1.548780 0.183285 -1.867948
O 0.718340 -2.549305 -1.226792
O 3.031094 1.090051 0.675735
C 0.273956 0.091690 0.490453
C -0.707259 -1.047927 0.103931
C 1.084327 0.583406 -0.718723
C -0.479016 1.210095 1.183627
C -1.632958 -0.697712 -1.048384
C 0.090685 -2.299681 -0.226980
C -1.243625 2.139777 0.465394
C -0.404370 1.310651 2.581706
C 2.318317 1.312638 -0.276312
C -1.927810 3.155947 1.137378
C -1.090479 2.327718 3.250628
C -1.854215 3.251694 2.530446
C -3.723637 -1.458245 -2.039848
C 0.766296 -4.400902 0.795210
C 3.764439 3.150585 -0.951484
C -4.646501 -0.314315 -1.681059
C 2.232119 -4.128201 1.048973
C 4.989960 2.399113 -1.427963
H 1.007562 -0.350724 1.227549
H -1.356128 -1.265674 1.006640
H 1.388885 -0.273805 -1.369454
H 0.459989 1.216148 -1.397258
H -1.304092 2.072619 -0.624939
H 0.196692 0.602591 3.151448
H -2.517157 3.876209 0.571999
H -1.026073 2.401848 4.335033
H -2.386516 4.044431 3.052373
H -4.203269 -2.451572 -1.962519
H -3.239847 -1.327748 -3.024184
H 0.580703 -4.879052 -0.182765
H 0.274804 -4.962786 1.610926
H 3.522895 4.032270 -1.572744
H 3.820697 3.423620 0.117267
H -4.136432 0.656228 -1.777231
H -5.002746 -0.390828 -0.645236
H -5.526401 -0.288656 -2.335229
H 2.797826 -5.059304 1.176116
H 2.689997 -3.578852 0.211905
H 2.383208 -3.521800 1.952118
H 4.853345 2.010054 -2.445289
H 5.204829 1.537974 -0.777273
H 5.878759 3.040310 -1.430594


%chk=000219467-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219467

0 1
O -2.800351 -1.651826 -1.108308
O 0.149381 -2.956928 0.909522
O 2.778254 2.238405 -1.148738
O -1.787796 0.302091 -1.871618
O 0.425577 -2.505162 -1.365497
O 2.949720 0.885579 0.743459
C 0.125328 0.214915 0.460076
C -0.862353 -0.950138 0.083451
C 0.974870 0.710099 -0.739859
C -0.594053 1.340598 1.214690
C -1.828643 -0.655856 -1.068749
C -0.050258 -2.208756 -0.244984
C -1.398560 2.307998 0.556257
C -0.465429 1.413983 2.625806
C 2.312935 1.258952 -0.272172
C -2.057469 3.316257 1.294334
C -1.124874 2.420980 3.365864
C -1.926296 3.377027 2.701155
C -3.822382 -1.554740 -2.199353
C 1.058516 -4.144757 0.791616
C 4.129157 2.813060 -0.854840
C -5.001815 -0.686228 -1.754407
C 2.516772 -3.720480 0.981990
C 5.233456 1.934862 -1.449934
H 0.836247 -0.239741 1.177721
H -1.469685 -1.181850 0.976036
H 1.192019 -0.133477 -1.426200
H 0.454877 1.465563 -1.345169
H -1.513544 2.269155 -0.531856
H 0.167939 0.683825 3.144624
H -2.673015 4.056291 0.769967
H -1.007449 2.463457 4.454685
H -2.436814 4.161856 3.270820
H -4.116994 -2.602452 -2.368690
H -3.332852 -1.144529 -3.099635
H 0.894987 -4.610688 -0.195814
H 0.709178 -4.813740 1.593747
H 4.092338 3.808748 -1.324770
H 4.237694 2.909703 0.239744
H -4.683103 0.357351 -1.594189
H -5.445297 -1.072081 -0.820482
H -5.783246 -0.692369 -2.536883
H 3.167167 -4.614795 0.975804
H 2.843423 -3.052486 0.167542
H 2.655011 -3.199061 1.944508
H 5.081397 1.791878 -2.533690
H 5.255455 0.948193 -0.957651
H 6.216976 2.417707 -1.299032


