%chk=000260293.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260293

0 1
O -2.810521 3.341703 0.014287
O -3.461139 0.666391 0.037552
N 0.221795 1.275408 0.203169
N 2.949166 0.307457 0.231069
C 1.381162 2.226385 0.197954
C 0.591764 0.030377 0.951395
C 2.583630 1.559760 -0.499956
C 1.794174 -0.642179 0.258382
C -1.003191 1.915720 0.772499
C -1.880561 2.348648 -0.424687
C 4.248588 -0.231351 0.021931
C -2.628175 1.161582 -1.054928
C 5.306620 0.597572 -0.412222
C 4.527626 -1.578082 0.358570
C 6.610681 0.095949 -0.495980
C 5.830774 -2.060003 0.268502
C 6.877708 -1.239564 -0.158399
C 7.715797 0.997813 -0.947765
C -4.292776 -0.403558 -0.211898
C -5.059198 -0.762940 0.914025
C -4.387809 -1.084799 -1.429709
C -5.944746 -1.836797 0.805911
C -5.284385 -2.158158 -1.510340
C -6.055613 -2.536352 -0.414097
C -6.780001 -2.251872 1.972713
H 1.676090 2.553778 1.219510
H 1.086703 3.135793 -0.368583
H -0.277150 -0.663251 0.926331
H 0.834851 0.223420 2.019275
H 2.338676 1.350893 -1.565417
H 3.448101 2.262584 -0.488076
H 2.077920 -1.556488 0.828469
H 1.510209 -0.964842 -0.768357
H -1.577313 1.209737 1.412594
H -0.797523 2.802587 1.409113
H -1.284907 2.886952 -1.199525
H -1.933811 0.363570 -1.371921
H -3.283845 1.478519 -1.882723
H 5.118528 1.637424 -0.667839
H 3.733952 -2.235627 0.703488
H -3.518309 2.931125 0.563206
H 6.036262 -3.097408 0.534549
H 7.886140 -1.632996 -0.225047
H 7.875808 1.813716 -0.228292
H 8.673183 0.472687 -1.057773
H 7.486851 1.458698 -1.918424
H -4.949259 -0.202165 1.836910
H -3.796086 -0.805922 -2.292428
H -5.375861 -2.703526 -2.450497
H -6.745941 -3.370869 -0.495512
H -6.583023 -1.655780 2.873321
H -7.852068 -2.151275 1.747619
H -6.601948 -3.304444 2.236653


%chk=000260293-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000260293

0 1
O -2.963904 3.479151 0.486794
O -3.463662 0.771910 0.166137
N 0.198968 1.403230 0.667924
N 2.905370 0.396272 0.452092
C 1.327008 2.308138 0.347562
C 0.669069 0.309649 1.551034
C 2.466215 1.548369 -0.357116
C 1.782181 -0.486013 0.849248
C -1.003241 2.114755 1.163778
C -1.907588 2.583437 -0.004591
C 4.190325 -0.165504 0.224596
C -2.511611 1.402511 -0.773249
C 5.033005 0.292426 -0.830704
C 4.696519 -1.191244 1.081231
C 6.337706 -0.225667 -1.026017
C 5.985145 -1.717152 0.879374
C 6.813980 -1.242820 -0.164996
C 7.206723 0.313380 -2.151915
C -4.177534 -0.360188 -0.268758
C -5.078187 -0.910188 0.677021
C -4.032012 -0.942596 -1.549467
C -5.848137 -2.050200 0.359854
C -4.805048 -2.085238 -1.864317
C -5.702256 -2.636870 -0.928353
C -6.815691 -2.642205 1.370965
H 1.733370 2.785491 1.274973
H 0.972162 3.115675 -0.318781
H -0.178768 -0.367102 1.763154
H 1.058463 0.700518 2.524591
H 2.121980 1.229956 -1.369807
H 3.314071 2.243656 -0.484435
H 2.144996 -1.274314 1.526174
H 1.348883 -0.982148 -0.050143
H -1.589951 1.427276 1.800887
H -0.750932 3.007565 1.780427
H -1.319184 3.198361 -0.709047
H -1.711996 0.689994 -1.052326
H -3.058071 1.754192 -1.669606
H 4.670784 1.048704 -1.535068
H 4.099056 -1.556290 1.922473
H -3.664973 2.901800 0.889559
H 6.353423 -2.499733 1.553271
H 7.817606 -1.658659 -0.308769
H 7.590378 1.324047 -1.911957
H 8.078501 -0.338421 -2.334200
H 6.640136 0.396301 -3.097791
H -5.162902 -0.431566 1.658785
H -3.340040 -0.530232 -2.288926
H -4.699078 -2.543912 -2.853999
H -6.292376 -3.522771 -1.190756
H -6.796445 -2.089692 2.325776
H -7.853900 -2.620873 0.989479
H -6.570933 -3.699168 1.586537


