%chk=000276846.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276846

0 1
O -3.076492 -3.431215 0.299836
O 3.946788 -2.787537 2.505624
O -1.112371 -2.379315 -1.592781
O 1.158241 -2.576022 1.680336
N -2.353039 1.899593 0.180512
N 2.411043 1.951593 0.646601
N 0.032898 1.925849 0.427390
C -3.942756 0.044328 -0.076794
C 3.906352 0.032384 0.282497
C -2.526421 0.527469 -0.133728
C 2.596134 0.549063 0.779961
C -4.174925 -1.347744 -0.060262
C 4.351588 -1.222408 0.753300
C -1.531879 -0.311354 -0.499298
C 1.699397 -0.281541 1.355598
C -1.148873 2.611314 0.364474
C 1.184537 2.646313 0.608337
C -5.043603 0.910712 -0.045698
C 4.684708 0.721568 -0.654818
C -3.029820 -2.312005 -0.135976
C 3.503429 -2.010383 1.701565
C -5.476785 -1.850668 0.024219
C 5.576109 -1.744919 0.329920
C -1.774574 -1.718932 -0.835249
C 1.981511 -1.706401 1.575745
C -6.346881 0.403431 0.021424
C 5.904857 0.185962 -1.088575
C -6.566706 -0.974391 0.062978
C 6.356471 -1.037830 -0.592819
C -1.219031 4.024252 0.492278
C 1.194488 4.058643 0.724165
C -0.028693 4.726702 0.668074
H -3.209509 2.454609 0.295907
H 3.256973 2.523710 0.585869
H -0.481812 -0.001490 -0.587313
H 0.701795 0.041344 1.674688
H -4.904839 1.991960 -0.079292
H 4.345627 1.666846 -1.077870
H -5.631110 -2.934001 0.060806
H 5.914552 -2.708676 0.722625
H -7.192783 1.091696 0.042465
H 6.501044 0.730722 -1.821918
H -7.581148 -1.368609 0.124241
H 7.309654 -1.448653 -0.926362
H -2.165578 4.549690 0.447477
H 2.117051 4.608943 0.866399
H -0.053120 5.814994 0.763541


%chk=000276846-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276846

0 1
O -3.843286 -3.407923 -1.287621
O 3.929083 -3.267899 1.938837
O -1.150002 -2.574054 -1.528997
O 1.234669 -2.448921 2.216779
N -2.391729 1.806234 0.124716
N 2.378565 1.850439 0.301631
N -0.006287 1.841132 0.216378
C -4.063816 0.020425 0.094479
C 4.067907 0.081932 0.367569
C -2.655109 0.452226 -0.141487
C 2.663570 0.513446 0.626382
C -4.466551 -1.292933 -0.302354
C 4.497972 -1.203847 0.821346
C -1.702052 -0.432361 -0.620333
C 1.735058 -0.353259 1.179765
C -1.181364 2.523307 0.151747
C 1.156394 2.546384 0.255465
C -5.030623 0.854763 0.717291
C 5.002895 0.889904 -0.333549
C -3.490701 -2.259386 -0.903646
C 3.552043 -2.145589 1.504102
C -5.801262 -1.721857 -0.110559
C 5.830337 -1.629872 0.608122
C -2.020979 -1.792837 -1.033461
C 2.081244 -1.687252 1.653388
C -6.360479 0.418547 0.905169
C 6.330592 0.456640 -0.542455
C -6.754735 -0.871261 0.482738
C 6.753527 -0.803805 -0.062974
C -1.244851 3.946669 0.131337
C 1.194675 3.970175 0.225884
C -0.031525 4.661430 0.166453
H -3.216541 2.398787 0.228195
H 3.193921 2.448651 0.161075
H -0.667232 -0.113412 -0.743899
H 0.701096 -0.038188 1.320104
H -4.766061 1.843277 1.110768
H 4.711211 1.850988 -0.772875
H -6.059264 -2.736211 -0.432449
H 6.110583 -2.622828 0.974960
H -7.083002 1.082128 1.391981
H 7.028601 1.098622 -1.090192
H -7.785351 -1.209555 0.628808
H 7.782461 -1.139788 -0.225420
H -2.204957 4.469473 0.074774
H 2.145288 4.511554 0.264330
H -0.041436 5.755499 0.147798


