%chk=000191241.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191241

0 1
O -2.096759 0.646436 -1.335484
O -6.365884 -0.814571 -0.799826
O 0.724245 -1.230624 1.702838
O 3.110233 -3.002770 -2.141708
O 4.373244 -2.181198 1.870000
O 5.040758 -1.912262 -0.254849
N -1.004509 0.602607 0.666113
N -4.630883 0.613355 -0.271895
N 1.996608 -1.319385 -0.191373
N 2.069892 6.572917 -0.522141
C -3.483941 0.656424 0.662456
C 0.332699 0.511162 0.043342
C -3.674145 -0.557072 1.614032
C 1.201415 1.737129 0.381655
C -4.977944 -1.244043 1.182973
C -2.156619 0.613884 -0.118879
C 0.729097 2.983170 -0.377176
C -5.437942 -0.531219 -0.078933
C 1.595544 4.199661 -0.034124
C 1.003957 -0.757867 0.615354
C 1.149089 5.438373 -0.828806
C 2.697017 -2.545001 0.224484
C 2.674672 -3.588839 -0.918781
C 4.152435 -2.168298 0.525196
H -3.528130 1.622955 1.232568
H 0.201632 0.429300 -1.076196
H -2.824885 -1.262974 1.556422
H -3.727691 -0.221416 2.664387
H 1.189902 1.927757 1.473990
H 2.260607 1.524034 0.128879
H -4.839074 -2.322504 0.978903
H -5.762867 -1.182865 1.960696
H 0.755642 2.794378 -1.469531
H -0.332902 3.190988 -0.138415
H -1.029023 0.519171 1.682111
H -4.520218 1.040496 -1.192152
H 1.554758 4.408090 1.051854
H 2.663298 3.993250 -0.256539
H 2.158181 -1.031525 -1.160998
H 1.219406 5.231426 -1.920929
H 0.082578 5.666773 -0.615891
H 2.217700 -2.963467 1.162389
H 3.291690 -4.471540 -0.671842
H 1.636798 -3.910039 -1.144662
H 1.818554 7.389567 -1.070738
H 2.001509 6.838307 0.455199
H 4.066404 -2.733310 -2.075243
H 5.308152 -1.929022 2.117472


%chk=000191241-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000191241

0 1
O -2.083337 1.097478 -1.409768
O -6.743142 -0.240441 -0.518020
O 0.644163 -1.477716 1.598122
O 3.616364 -2.897930 -2.124355
O 4.217380 -1.628278 1.992149
O 5.330612 -2.209566 0.043745
N -0.990821 0.352115 0.511775
N -4.583586 0.694497 -0.302528
N 2.101384 -1.455834 -0.218888
N 1.854338 6.511100 -0.422427
C -3.430556 0.669333 0.601945
C 0.346261 0.282461 -0.092235
C -3.685890 -0.617322 1.456715
C 1.213218 1.546461 0.202390
C -5.226317 -0.782466 1.413370
C -2.113525 0.710856 -0.199676
C 0.619299 2.845889 -0.381021
C -5.647946 -0.106093 0.089541
C 1.530124 4.066106 -0.122887
C 1.031660 -0.967679 0.500131
C 0.947689 5.376250 -0.692372
C 2.886224 -2.619194 0.220201
C 3.055678 -3.598643 -0.962723
C 4.267132 -2.151732 0.711860
H -3.431698 1.563299 1.265499
H 0.213694 0.188427 -1.188052
H -3.199554 -1.484482 0.974629
H -3.289013 -0.523273 2.481754
H 1.335896 1.643509 1.299784
H 2.225597 1.382457 -0.219601
H -5.562220 -1.831245 1.421451
H -5.727414 -0.263695 2.252228
H 0.453212 2.721492 -1.469401
H -0.379767 3.025002 0.061981
H -1.065627 -0.099933 1.431944
H -4.543400 1.194016 -1.193207
H 1.690450 4.183408 0.970718
H 2.529539 3.909896 -0.573575
H 2.315277 -1.110034 -1.160489
H 0.845910 5.275291 -1.790116
H -0.086123 5.513769 -0.287626
H 2.343694 -3.077728 1.066493
H 3.685587 -4.459491 -0.663595
H 2.067253 -3.963558 -1.283101
H 1.633899 7.364571 -0.944511
H 1.991757 6.701087 0.575859
H 4.563983 -2.685205 -1.903982
H 5.116960 -1.297432 2.266074


