%chk=000259564.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259564

0 1
O -3.624845 -0.758843 -1.435419
O 1.888721 1.213573 0.945311
O -2.747033 0.170933 3.103725
O -5.638104 -0.461412 -0.440564
O 0.411292 -0.177921 -0.143434
N -2.398825 -0.043235 0.854680
N 0.419489 0.031413 2.174862
C -0.679941 -0.937153 2.398381
C -3.650886 0.648747 0.490863
C -2.037073 -0.204348 2.189042
C -0.611445 -1.495019 3.813015
C -3.387883 1.996234 -0.177248
C -4.453119 -0.239471 -0.475511
C 0.861809 0.293381 0.888273
C 2.552943 1.525445 -0.325265
C 3.615265 0.502238 -0.604521
C -4.209085 -1.626974 -2.460303
C 4.951176 0.759678 -0.266379
C 3.268501 -0.715641 -1.208890
C -4.943868 -0.791136 -3.486488
C 5.936240 -0.192934 -0.543435
C 4.256033 -1.664868 -1.481579
C 5.590483 -1.403720 -1.151859
H -0.588148 -1.773778 1.648170
H -4.278329 0.791771 1.423990
H -1.754171 -0.265145 0.081095
H 0.371637 -1.923989 4.040858
H -1.361189 -2.287371 3.955894
H -0.840549 -0.727777 4.570087
H -2.791901 1.893606 -1.094534
H -4.325706 2.500821 -0.444076
H -2.838494 2.666731 0.497816
H 0.815758 0.517909 2.976283
H 1.791268 1.582113 -1.126657
H 2.951178 2.533550 -0.101094
H -4.864254 -2.363025 -1.961678
H -3.299339 -2.111881 -2.859495
H 5.224514 1.697180 0.215146
H 2.221496 -0.920390 -1.453480
H -5.842762 -0.328065 -3.050873
H -4.314772 0.020936 -3.872354
H -5.268414 -1.397899 -4.340055
H 6.973876 0.008439 -0.282594
H 3.985387 -2.609495 -1.950873
H 6.359369 -2.143906 -1.367235


%chk=000259564-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259564

0 1
O -3.438570 -0.915345 -1.271059
O 1.646379 1.089866 0.661707
O -2.907089 0.292192 3.375783
O -5.584213 -0.028004 -1.027849
O 0.093198 -0.538056 -0.068698
N -2.616434 -0.205944 1.117507
N 0.261467 0.106182 2.175712
C -0.794093 -0.810777 2.661696
C -3.910072 0.372830 0.728030
C -2.205885 -0.188391 2.430724
C -0.573814 -1.136868 4.144321
C -3.859063 1.924289 0.623517
C -4.425411 -0.205730 -0.590148
C 0.620880 0.155129 0.853729
C 2.176316 1.196685 -0.742507
C 3.359401 0.279528 -0.962515
C -3.803147 -1.462938 -2.616783
C 4.682545 0.764005 -0.805903
C 3.157835 -1.076503 -1.331039
C -3.586634 -0.405576 -3.701934
C 5.789225 -0.090324 -1.010136
C 4.263178 -1.931666 -1.533316
C 5.581012 -1.440890 -1.374552
H -0.720609 -1.727765 2.047457
H -4.646495 0.118196 1.513538
H -1.982684 -0.557791 0.384595
H 0.438388 -1.547940 4.303275
H -1.316072 -1.878597 4.481589
H -0.716211 -0.237000 4.767650
H -3.126345 2.241488 -0.139473
H -4.853447 2.319517 0.355146
H -3.561883 2.334430 1.602516
H 0.712339 0.747119 2.830712
H 1.345397 0.965186 -1.431019
H 2.459456 2.258187 -0.818819
H -4.854562 -1.797894 -2.581138
H -3.128619 -2.325509 -2.734060
H 4.845453 1.811174 -0.522022
H 2.134021 -1.450908 -1.444801
H -4.278438 0.442592 -3.566902
H -2.548524 -0.031658 -3.684436
H -3.777197 -0.850031 -4.696398
H 6.807957 0.294391 -0.888744
H 4.099236 -2.977057 -1.817854
H 6.438129 -2.104523 -1.535503


