%chk=000192490.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192490

0 1
O -0.296138 0.649413 0.925871
O 0.756897 0.646986 -2.558170
O 4.832897 2.705577 -0.973599
O 5.960204 1.100180 0.910948
O -2.098763 0.188194 -2.758328
O -4.449894 0.187640 -1.570174
O -5.816928 0.342235 0.829920
C 1.899728 0.688087 0.097337
C 2.524630 -0.137273 1.052215
C 0.473487 0.576218 -0.232927
C 1.769297 -1.212162 1.787764
C -2.315356 0.420359 -0.431167
C -0.089795 0.493679 -1.474790
C -1.679462 0.572722 0.816779
C 2.642052 1.654688 -0.618226
C 3.898582 0.019339 1.311059
C -1.540930 0.356170 -1.675859
C 3.994179 1.799119 -0.353669
C 4.632469 0.982136 0.621575
C 1.588942 -2.423801 0.922041
C -3.722835 0.340213 -0.443313
C -2.376857 0.651753 2.024011
C -4.445224 0.418370 0.778682
C 0.451451 -3.128125 0.816103
C -3.774191 0.575210 1.995129
C 0.369326 -4.340000 -0.062562
C -0.810527 -2.796385 1.548080
C 0.692759 -0.433088 -3.533721
H 2.305377 -1.509332 2.716469
H 0.787292 -0.817494 2.142233
H 2.146981 2.258830 -1.382062
H 4.406101 -0.609688 2.043049
H 2.482770 -2.713942 0.369553
H -1.842165 0.780385 2.962941
H -4.356821 0.636589 2.917591
H 1.338730 -4.623718 -0.491291
H -0.004699 -5.210624 0.493315
H -0.319349 -4.170950 -0.902011
H -0.803647 -1.773079 1.954385
H -1.693297 -2.880677 0.900496
H -0.962738 -3.480705 2.394328
H 4.355641 3.214631 -1.674606
H 6.386726 1.815435 0.352437
H -0.310171 -0.475652 -3.976687
H 0.971655 -1.378435 -3.064348
H 1.439601 -0.110349 -4.267011
H -3.831208 0.145137 -2.416292
H -6.195179 0.252085 -0.090195


%chk=000192490-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000192490

0 1
O -0.279008 0.582625 0.929063
O 0.814180 0.587443 -2.598444
O 4.916198 2.770748 -1.019016
O 6.058696 1.292732 0.930785
O -2.079550 0.391075 -2.842177
O -4.381976 0.282146 -1.734328
O -5.875028 0.278770 0.582673
C 1.961967 0.680668 0.082940
C 2.604063 -0.105016 1.094815
C 0.521953 0.560405 -0.219316
C 1.898205 -1.245758 1.828957
C -2.290115 0.416953 -0.450648
C -0.048680 0.508624 -1.497526
C -1.678450 0.492753 0.828994
C 2.712799 1.643140 -0.649925
C 3.975384 0.121789 1.356650
C -1.494190 0.438016 -1.673342
C 4.068192 1.844229 -0.369568
C 4.710146 1.089555 0.646985
C 1.464391 -2.357086 0.879631
C -3.710645 0.348687 -0.524014
C -2.434661 0.497776 2.014395
C -4.483335 0.348112 0.662051
C 0.324464 -3.104933 0.935583
C -3.843019 0.423697 1.919232
C 0.063410 -4.193379 -0.094281
C -0.755577 -2.958407 1.992475
C 0.663721 -0.469586 -3.633148
H 2.605977 -1.658925 2.575344
H 1.032005 -0.862585 2.393669
H 2.218173 2.219065 -1.438628
H 4.497961 -0.468978 2.115283
H 2.187889 -2.580688 0.080658
H -1.934428 0.567164 2.983233
H -4.464519 0.428191 2.819193
H 0.887672 -4.274004 -0.824157
H -0.062417 -5.181217 0.392033
H -0.874407 -3.995374 -0.651214
H -0.575843 -2.118954 2.682973
H -1.747917 -2.807227 1.524077
H -0.829418 -3.883700 2.598226
H 4.448771 3.264357 -1.734192
H 6.410136 2.003422 0.330776
H -0.340537 -0.420279 -4.082646
H 0.843728 -1.464712 -3.184367
H 1.442778 -0.244201 -4.376603
H -3.645493 0.313818 -2.471568
H -6.132046 0.244949 -0.378287


