%chk=000248131.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248131

0 1
O 0.311152 -0.073451 -2.137954
O 3.328499 -0.681355 1.096020
O 0.220164 -1.482243 -0.368661
O 3.747052 -0.667943 -1.132005
O 2.913442 3.016174 0.408521
O -5.198977 -1.559360 1.288651
O -3.257067 -2.505932 1.306711
N 1.985096 1.605498 -1.152991
N -1.405506 3.458092 1.254628
N -3.975875 -1.518757 1.293157
C 1.723388 0.459688 -0.267941
C 1.235974 0.841486 1.148140
C -0.002229 1.654189 1.167536
C -1.365988 1.165819 1.208878
C -2.221517 2.327165 1.262065
C -0.054917 3.037775 1.202821
C 0.673224 -0.495908 -0.893230
C 3.051659 -0.361619 -0.195845
C -1.943518 -0.108034 1.223658
C -3.630555 2.222899 1.313783
C -3.335314 -0.195726 1.277127
C 2.600997 2.801222 -0.748572
C -4.173776 0.956726 1.320844
C -0.649252 -0.896482 -2.892617
C 4.526847 -1.490289 1.367316
C 2.821410 3.775430 -1.870994
C 0.051909 -2.114811 -3.446244
C 4.249382 -2.936423 1.025265
H 2.064401 1.395462 1.665625
H 1.101545 -0.095008 1.741596
H 0.764295 3.743459 1.204236
H 1.763547 1.449303 -2.143189
H -1.713936 4.410928 1.299288
H -1.322213 -1.016188 1.186379
H -4.254921 3.110587 1.350448
H -5.259187 0.808269 1.361501
H -0.961709 -0.172521 -3.667089
H -1.489353 -1.149020 -2.220849
H 4.645578 -1.307077 2.451482
H 5.371084 -1.064089 0.797759
H 1.893644 4.044696 -2.392451
H 3.257624 4.708673 -1.476748
H 3.528102 3.389605 -2.620653
H -0.584449 -2.654618 -4.159066
H 0.317196 -2.824590 -2.646534
H 0.984087 -1.851546 -3.963939
H 5.043937 -3.596693 1.393505
H 4.173164 -3.086402 -0.062184
H 3.301557 -3.281157 1.462917


%chk=000248131-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248131

0 1
O 0.195736 -0.435969 -1.832464
O 3.468034 -0.755473 1.104529
O 0.599604 -1.812629 0.003088
O 3.873486 -0.174643 -1.116432
O 3.140734 2.822894 0.222277
O -5.466687 -0.971673 0.260505
O -3.474689 -2.016836 -0.111197
N 1.633047 1.547630 -0.999597
N -1.235751 3.535185 1.798462
N -4.173355 -0.991697 0.269775
C 1.682481 0.405250 -0.085679
C 1.236681 0.757766 1.387945
C 0.026849 1.650235 1.470786
C -1.376179 1.326124 1.246871
C -2.141610 2.535583 1.458815
C 0.065261 3.002789 1.801410
C 0.781974 -0.741786 -0.615468
C 3.139100 -0.184752 -0.106267
C -2.059123 0.145350 0.879034
C -3.548647 2.582982 1.319090
C -3.456979 0.217378 0.715855
C 2.405645 2.675303 -0.805604
C -4.211530 1.406294 0.941158
C -0.715762 -1.481656 -2.429324
C 4.798509 -1.447381 1.177091
C 2.335987 3.713879 -1.918193
C 0.096468 -2.561683 -3.143390
C 4.685343 -2.877757 0.645912
H 2.090593 1.263035 1.863117
H 1.077281 -0.201300 1.909744
H 0.933161 3.620839 2.024498
H 1.091262 1.420708 -1.857126
H -1.475383 4.499580 2.019644
H -1.546536 -0.808252 0.730124
H -4.110747 3.506427 1.492388
H -5.295368 1.376247 0.807147
H -1.338778 -0.894768 -3.122279
H -1.339566 -1.895407 -1.618162
H 5.039502 -1.416922 2.251123
H 5.528957 -0.851730 0.602485
H 1.449339 3.598166 -2.565149
H 2.334701 4.722523 -1.474697
H 3.241599 3.627421 -2.545601
H -0.596970 -3.263852 -3.641851
H 0.705680 -3.135336 -2.425941
H 0.757303 -2.123993 -3.911107
H 5.645608 -3.404909 0.797084
H 4.458129 -2.879775 -0.433102
H 3.895303 -3.433503 1.178770


