%chk=000254307.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254307

0 1
O -5.129122 1.343443 -1.741185
O -3.505397 -1.394041 1.721894
O -1.080390 -0.527133 -2.130333
O -4.576500 -0.809371 -2.160782
O 3.455128 0.380411 1.879246
O 1.744102 -0.154583 0.447354
N -2.488146 -0.672630 -0.255367
N 1.634733 1.676207 1.935064
C -3.331967 0.517136 -0.458239
C -2.517105 1.769844 -0.827662
C -2.675116 -1.565151 0.869373
C -1.421317 -1.107598 -1.135336
C -1.644755 -2.636810 0.682161
C -0.902579 -2.365737 -0.501452
C -1.704819 2.255025 0.340950
C -4.367463 0.208287 -1.554293
C -1.369808 -3.739849 1.461511
C 0.122834 -3.192340 -0.906920
C -0.422065 1.736284 0.556357
C -2.230673 3.220183 1.213153
C 0.322806 2.181070 1.658032
C -0.321337 -4.594240 1.044287
C 0.406749 -4.326766 -0.109057
C -1.470121 3.665938 2.297624
C -0.192988 3.156599 2.535088
C -6.192845 1.259591 -2.727541
C 2.204642 0.565962 1.307520
C 4.293967 -0.663504 1.285168
C 5.038680 -0.105415 0.106703
C 4.401446 -0.006181 -1.139336
C 6.368944 0.314269 0.246756
C 5.095688 0.502525 -2.239321
C 7.060558 0.819608 -0.858173
C 6.426020 0.913103 -2.100893
H -3.904605 0.705366 0.502423
H -1.857599 1.557503 -1.703598
H -3.214988 2.563258 -1.180977
H -0.007848 0.990875 -0.130813
H -1.936819 -3.951332 2.368634
H 0.700351 -2.980974 -1.807888
H -3.227898 3.621907 1.048874
H -0.088244 -5.474284 1.645305
H 1.212919 -4.995907 -0.413236
H -1.880133 4.419388 2.971275
H 0.382739 3.508306 3.386340
H 2.183151 2.145529 2.662778
H -6.692064 2.228294 -2.622881
H -6.859147 0.425401 -2.484685
H -5.753181 1.127937 -3.721140
H 4.943743 -0.915622 2.144909
H 3.658056 -1.529358 1.017764
H 3.356815 -0.316294 -1.241831
H 6.864949 0.252802 1.213875
H 4.597917 0.581391 -3.205029
H 8.094098 1.143688 -0.749050
H 6.966005 1.307989 -2.959900


%chk=000254307-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000254307

0 1
O -5.259619 1.309945 -1.880260
O -3.434710 -1.185645 1.931630
O -1.423120 -0.615256 -2.288409
O -4.732530 -0.955326 -1.984870
O 3.468745 0.342458 1.750231
O 1.748895 -0.093253 0.191373
N -2.602584 -0.599867 -0.217905
N 1.593874 1.593965 1.851264
C -3.479229 0.548652 -0.444621
C -2.700661 1.868412 -0.759157
C -2.668607 -1.403710 0.961407
C -1.663879 -1.114609 -1.162174
C -1.665188 -2.494124 0.759535
C -1.063001 -2.319447 -0.509424
C -1.820065 2.301617 0.402465
C -4.521941 0.183690 -1.522084
C -1.297329 -3.550870 1.605625
C -0.067346 -3.189855 -0.973306
C -0.519919 1.759588 0.542801
C -2.299954 3.227288 1.362803
C 0.287967 2.122571 1.649157
C -0.295786 -4.442891 1.142384
C 0.310684 -4.264147 -0.127325
C -1.484291 3.603764 2.453025
C -0.196013 3.054427 2.604686
C -6.334593 1.076701 -2.878100
C 2.207086 0.563458 1.161735
C 4.309595 -0.715601 1.092163
C 5.204545 -0.134648 0.018785
C 4.722116 0.035140 -1.305564
C 6.536360 0.244566 0.323769
C 5.558858 0.580704 -2.303807
C 7.374845 0.788567 -0.674770
C 6.886648 0.957495 -1.991412
H -4.039499 0.686406 0.503329
H -2.102996 1.705551 -1.672329
H -3.459058 2.637295 -0.981067
H -0.126384 1.063223 -0.200611
H -1.770386 -3.675890 2.584594
H 0.397913 -3.036103 -1.951537
H -3.303563 3.654782 1.254336
H 0.015835 -5.282673 1.772960
H 1.082943 -4.967790 -0.456688
H -1.852529 4.324369 3.191328
H 0.428963 3.341516 3.459682
H 2.142820 1.979974 2.622523
H -6.797504 2.062050 -3.025900
H -7.062312 0.346083 -2.487438
H -5.900661 0.692859 -3.816080
H 4.890442 -1.126224 1.933012
H 3.624062 -1.479021 0.684986
H 3.689696 -0.249753 -1.537989
H 6.915079 0.114664 1.345283
H 5.178200 0.709993 -3.323033
H 8.403184 1.076947 -0.429768
H 7.535902 1.377985 -2.767744


