%chk=000255514.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255514

0 1
O -1.272567 0.697085 -1.849431
O 1.314425 -0.658731 -3.125354
O 4.102867 0.540710 0.065141
O 2.602808 -1.070225 0.595690
C -0.981013 -0.126258 -0.695859
C 0.145719 -1.101841 -1.094838
C -2.245461 -0.872567 -0.278884
C -0.593797 0.865924 0.392553
C 1.213482 -0.449809 -1.941024
C -3.493923 -0.380940 -0.685125
C -0.955608 2.214480 0.262123
C -2.179535 -2.015787 0.528479
C 0.087844 0.437350 1.540077
C 2.176958 0.492948 -1.237892
C -4.665724 -1.039745 -0.304752
C -0.632001 3.127342 1.269383
C -3.354076 -2.671897 0.908869
C 0.405556 1.352722 2.546838
C -4.597615 -2.188074 0.490615
C 0.046894 2.698039 2.413898
C 2.924312 -0.135578 -0.105730
C 5.011881 0.091864 1.124717
C 5.745325 -1.153617 0.677229
H 0.615492 -1.553490 -0.186053
H -0.281134 -1.962934 -1.654400
H -3.544119 0.524949 -1.293352
H -1.489977 2.545439 -0.632585
H -1.218887 -2.397805 0.870585
H 0.385529 -0.607807 1.649170
H -1.456961 0.141390 -2.638127
H 1.603324 1.378671 -0.858522
H 2.887882 0.927939 -1.982734
H -5.632619 -0.655038 -0.625206
H -0.914289 4.173483 1.162892
H -3.298644 -3.561053 1.534923
H 0.931894 1.014105 3.437791
H -5.510542 -2.701608 0.786913
H 0.293652 3.408606 3.200608
H 4.424869 -0.064214 2.046709
H 5.666926 0.978032 1.216702
H 6.545950 -1.421804 1.376970
H 5.064628 -2.015898 0.609071
H 6.199374 -1.021660 -0.313979


%chk=000255514-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000255514

0 1
O -1.044379 0.805568 -1.875591
O 1.500118 1.811268 -1.573153
O 4.696245 -0.565804 -0.179317
O 3.100772 -1.053564 1.456031
C -0.834535 0.397793 -0.477529
C 0.645370 -0.099775 -0.318177
C -1.776278 -0.798816 -0.222161
C -1.151972 1.579739 0.469044
C 1.681412 0.969602 -0.647570
C -2.347062 -1.494687 -1.315512
C -2.159846 2.498364 0.081057
C -2.040877 -1.247732 1.095895
C -0.509305 1.763676 1.720020
C 2.975436 1.058513 0.184451
C -3.168754 -2.622890 -1.092446
C -2.512837 3.577684 0.918304
C -2.856505 -2.379094 1.317338
C -0.860009 2.846982 2.559123
C -3.423695 -3.072726 0.223145
C -1.862783 3.758723 2.162002
C 3.565287 -0.286090 0.578698
C 5.364191 -1.887459 0.071438
C 4.704232 -2.989688 -0.760133
H 0.830419 -0.532118 0.678042
H 0.779203 -0.926676 -1.045991
H -2.150542 -1.128862 -2.326537
H -2.649928 2.354975 -0.886817
H -1.630261 -0.705222 1.954763
H 0.260934 1.061845 2.062446
H -0.295846 1.431998 -2.100826
H 2.701020 1.590183 1.117209
H 3.704413 1.664580 -0.372890
H -3.611257 -3.148685 -1.946447
H -3.293112 4.279021 0.601419
H -3.054825 -2.713550 2.341965
H -0.352380 2.973686 3.522292
H -4.060613 -3.947906 0.395061
H -2.134595 4.598182 2.811715
H 5.308347 -2.106015 1.152175
H 6.407361 -1.704612 -0.230061
H 5.263321 -3.934836 -0.631393
H 3.664720 -3.161190 -0.433956
H 4.708494 -2.731691 -1.833030


