%chk=000189474.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189474

0 1
O 1.031263 -0.783518 0.080868
C -0.995414 0.414630 0.233057
C -1.775465 1.763386 0.153561
C 0.427043 0.496584 -0.369688
C 1.215574 1.638156 0.320989
C -0.907413 2.914734 0.728142
C 0.495456 2.974616 0.109775
C -1.826968 -0.739020 -0.351112
C -3.042071 1.600298 1.043882
C 2.678992 1.642920 -0.145814
C -2.223860 2.120623 -1.272171
C 0.503898 0.484944 -1.890152
C -3.220773 -0.762395 0.213256
C -3.761656 0.303831 0.821807
C 3.254844 0.260266 -0.033328
C 2.404282 -0.863318 0.070564
C -4.007349 -2.052333 0.057336
C 4.636145 0.042632 -0.014155
C 2.911542 -2.166461 0.208013
C -4.089594 -2.480771 -1.413693
C -3.392552 -3.159000 0.924687
C 5.155167 -1.249756 0.113881
C 4.293646 -2.346901 0.230421
H -0.851626 0.183865 1.324614
H 1.221994 1.412540 1.421381
H -0.817014 2.799808 1.825815
H -1.423479 3.880250 0.573392
H 0.434033 3.220149 -0.966915
H 1.074313 3.795617 0.573522
H -1.302121 -1.696771 -0.145210
H -1.886700 -0.660895 -1.455974
H -3.732211 2.447829 0.865498
H -2.763212 1.663855 2.116512
H 3.265102 2.357974 0.465424
H 2.762267 2.003715 -1.191355
H -1.376056 2.147716 -1.970910
H -2.943951 1.387007 -1.654428
H -2.711182 3.099540 -1.306386
H 1.536128 0.560856 -2.251082
H 0.100805 -0.453814 -2.292137
H -0.073105 1.314741 -2.326460
H -4.775006 0.282678 1.218344
H -5.055813 -1.880060 0.417546
H 5.315984 0.889585 -0.096021
H 2.223567 -3.002786 0.294627
H -3.112258 -2.779518 -1.807706
H -4.466192 -1.666669 -2.042279
H -4.763301 -3.335480 -1.536563
H -3.330467 -2.848957 1.973977
H -2.376189 -3.412232 0.601125
H -3.989475 -4.075358 0.880255
H 6.231012 -1.401598 0.126625
H 4.703916 -3.350235 0.336846


%chk=000189474-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189474

0 1
O 1.044405 -0.811714 0.090223
C -1.008892 0.439398 0.177443
C -1.798867 1.800100 0.138036
C 0.441204 0.493929 -0.391489
C 1.223976 1.650849 0.291459
C -0.909586 2.950324 0.700993
C 0.505143 3.000013 0.081092
C -1.853067 -0.724081 -0.392447
C -3.032755 1.611490 1.076001
C 2.702043 1.643201 -0.149375
C -2.322982 2.179816 -1.275067
C 0.576505 0.487976 -1.928676
C -3.249092 -0.779508 0.215203
C -3.765927 0.298050 0.868747
C 3.297329 0.246157 -0.029794
C 2.449799 -0.892047 0.092763
C -4.048540 -2.076914 0.066739
C 4.697302 0.036938 0.000923
C 2.993910 -2.189286 0.255402
C -4.181553 -2.514010 -1.416420
C -3.441407 -3.225451 0.919914
C 5.252676 -1.251598 0.152026
C 4.390942 -2.367854 0.286283
H -0.859841 0.217995 1.257372
H 1.194564 1.427319 1.379995
H -0.798827 2.811410 1.797186
H -1.430449 3.917980 0.555576
H 0.454994 3.247750 -0.998056
H 1.094421 3.807962 0.558284
H -1.312066 -1.671890 -0.211790
H -1.945985 -0.635601 -1.494852
H -3.735696 2.458130 0.929319
H -2.701834 1.678308 2.136096
H 3.280367 2.350078 0.476655
H 2.787328 2.015183 -1.191673
H -1.513037 2.352070 -2.003302
H -2.989651 1.399759 -1.682476
H -2.911687 3.114726 -1.209337
H 1.614221 0.250585 -2.220199
H -0.074829 -0.278872 -2.377170
H 0.317318 1.463759 -2.371913
H -4.775252 0.225287 1.301292
H -5.069807 -1.881288 0.453971
H 5.359638 0.908055 -0.086615
H 2.306880 -3.035912 0.353579
H -3.193882 -2.755361 -1.851460
H -4.641106 -1.716883 -2.029413
H -4.812443 -3.418671 -1.498987
H -3.374965 -2.935197 1.983915
H -2.424585 -3.490763 0.575049
H -4.067241 -4.134765 0.846312
H 6.339447 -1.385263 0.172670
H 4.805940 -3.374165 0.412197


