%chk=000296356.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296356

0 1
O -3.772928 0.123338 0.587512
C 1.896799 -0.031794 -0.001403
C 2.325279 1.163281 -0.905100
C 2.273237 -1.349773 -0.742809
C 0.385068 0.013199 0.212533
C 2.687439 0.037064 1.317416
C 1.916047 2.524988 -0.351838
C 1.809849 -2.611025 -0.020075
C -0.462247 -0.041193 -0.914247
C -0.192189 0.106162 1.482836
C -1.851490 -0.004891 -0.795638
C -1.583199 0.145140 1.642072
C -2.394029 0.089552 0.507609
C -2.737463 -0.063095 -1.993753
H 1.891781 1.037328 -1.916221
H 3.423057 1.135107 -1.044469
H 3.370859 -1.384967 -0.881834
H 1.842469 -1.337136 -1.762818
H 2.483155 0.965362 1.862019
H 3.766273 0.002921 1.131230
H 2.446857 -0.804458 1.976217
H 2.383717 2.727035 0.618288
H 2.207128 3.331388 -1.033475
H 0.829444 2.589302 -0.208532
H 0.721890 -2.611707 0.127320
H 2.065827 -3.509684 -0.591497
H 2.271298 -2.705594 0.969272
H -0.023593 -0.113819 -1.910127
H 0.428528 0.150256 2.376535
H -2.016076 0.217418 2.634261
H -2.585956 -0.991759 -2.560158
H -3.802964 -0.023296 -1.714531
H -2.549492 0.779073 -2.673173
H -4.078874 0.188777 1.522778


%chk=000296356-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296356

0 1
O -3.889720 0.121906 0.607543
C 1.890632 -0.034284 0.011004
C 2.338277 1.157447 -0.910115
C 2.286306 -1.360888 -0.732552
C 0.358881 0.009869 0.220821
C 2.671538 0.046595 1.347969
C 2.013199 2.571758 -0.383903
C 1.934992 -2.672937 0.001188
C -0.513010 -0.025639 -0.901137
C -0.242783 0.084466 1.501455
C -1.922222 0.011158 -0.796604
C -1.646917 0.121816 1.647672
C -2.480052 0.085640 0.507511
C -2.807689 -0.026057 -2.029776
H 1.868273 1.030480 -1.906147
H 3.432209 1.065968 -1.073107
H 3.378307 -1.327772 -0.927859
H 1.795675 -1.366028 -1.726656
H 2.460900 0.982445 1.895554
H 3.758417 0.013929 1.145514
H 2.431614 -0.796091 2.020191
H 2.543629 2.793204 0.559982
H 2.317383 3.338200 -1.120652
H 0.929881 2.688608 -0.200542
H 0.855519 -2.722311 0.231294
H 2.188785 -3.547185 -0.626455
H 2.490955 -2.775949 0.950536
H -0.087233 -0.083041 -1.911270
H 0.376374 0.114588 2.402576
H -2.089752 0.179657 2.651510
H -2.632633 -0.947451 -2.616191
H -3.872431 0.008161 -1.753803
H -2.596118 0.831709 -2.695366
H -4.165685 0.170526 1.556016


