%chk=000270452.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270452

0 1
O 1.800956 0.342331 -0.172546
O 1.118788 2.452616 0.320192
O -5.372183 -0.160871 0.110337
O -4.560884 -2.100248 -0.401326
N -4.445854 -0.917684 -0.126148
C 3.264827 0.661566 -0.174823
C 3.853839 -0.714247 -0.530847
C 3.597726 -1.791307 0.530996
C 3.515972 1.684366 -1.275470
C 3.643621 1.176939 1.203435
C 4.067310 -3.165510 0.061313
C 0.863374 1.292671 0.081642
C -0.505713 0.688494 0.020127
C -1.603435 1.520848 0.286930
C -0.689863 -0.664977 -0.294499
C -2.896871 0.998865 0.240212
C -1.980150 -1.195623 -0.343610
C -3.070353 -0.356220 -0.075071
H 4.941838 -0.603190 -0.704227
H 3.425263 -1.047405 -1.498909
H 2.514580 -1.821042 0.769100
H 4.111759 -1.524822 1.475279
H 3.024751 2.644614 -1.047406
H 3.125371 1.349958 -2.243314
H 4.584283 1.892034 -1.398523
H 3.272742 0.523278 2.001974
H 3.216820 2.176255 1.388649
H 4.730137 1.257947 1.317138
H 5.139807 -3.173319 -0.164346
H 3.540262 -3.488217 -0.843879
H 3.890343 -3.926824 0.830095
H -1.436761 2.576411 0.529849
H 0.181076 -1.297237 -0.499987
H -3.768408 1.630928 0.445072
H -2.147570 -2.250679 -0.587406


%chk=000270452-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270452

0 1
O 1.768709 0.305336 -0.170150
O 1.032065 2.477443 0.337463
O -5.546540 -0.021108 0.120743
O -4.741894 -2.085812 -0.419038
N -4.579403 -0.838527 -0.128755
C 3.265305 0.648137 -0.168990
C 3.914816 -0.717152 -0.500695
C 3.719319 -1.836480 0.546367
C 3.535473 1.668154 -1.292939
C 3.662380 1.185729 1.219495
C 4.273363 -3.189664 0.049813
C 0.806459 1.266831 0.082496
C -0.577456 0.681859 0.017499
C -1.673360 1.542968 0.284403
C -0.804898 -0.682679 -0.299203
C -2.990593 1.051928 0.238783
C -2.117661 -1.187937 -0.349666
C -3.190220 -0.309995 -0.078500
H 4.998817 -0.539512 -0.653472
H 3.509419 -1.056676 -1.474771
H 2.641026 -1.934879 0.775615
H 4.222656 -1.562610 1.493619
H 3.028313 2.625317 -1.094947
H 3.196106 1.273363 -2.267074
H 4.622541 1.856694 -1.359057
H 3.317286 0.511603 2.021545
H 3.237387 2.186523 1.392018
H 4.764376 1.251854 1.279065
H 5.353968 -3.119981 -0.178345
H 3.757029 -3.516150 -0.872506
H 4.140311 -3.981055 0.809643
H -1.467579 2.590597 0.524485
H 0.050445 -1.330734 -0.504262
H -3.854200 1.690523 0.440314
H -2.326367 -2.233214 -0.590991


