%chk=000250393.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250393

0 1
O -1.997084 -1.633573 -0.311688
O 3.334740 2.070714 0.606597
O 4.718439 -1.671519 -0.570355
O 5.370104 0.375468 0.023557
N -3.546046 -0.040042 0.241467
N -1.189985 0.470138 0.272628
C -4.653808 -1.004322 -0.031616
C -3.923039 1.357428 0.563475
C -2.233500 -0.487442 0.034782
C 0.196818 0.213816 0.154186
C -5.217591 -1.571732 1.267791
C -3.919799 2.255080 -0.672468
C 1.065612 1.285492 0.447854
C 0.719354 -1.038742 -0.240777
C 2.448048 1.075645 0.336962
C 2.994375 -0.166721 -0.056857
C 2.088419 -1.214300 -0.340846
C 4.436099 -0.368042 -0.167753
H -5.444564 -0.487577 -0.617500
H -4.260758 -1.834963 -0.670460
H -4.937794 1.349480 1.027168
H -3.239417 1.760294 1.345376
H -1.450743 1.413950 0.572728
H -4.442784 -2.101365 1.840254
H -5.628800 -0.795555 1.921484
H -6.017679 -2.293408 1.062910
H -2.945125 2.275525 -1.175133
H -4.646336 1.913597 -1.421929
H -4.181364 3.287832 -0.413626
H 0.687010 2.252355 0.753253
H 0.039666 -1.870283 -0.466550
H 2.496712 -2.186149 -0.647369
H 2.892610 2.917259 0.878980
H 5.694510 -1.826439 -0.650823


%chk=000250393-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250393

0 1
O -2.089477 -1.748128 -0.372903
O 3.270613 2.202023 0.394757
O 4.791355 -1.760915 -0.305756
O 5.396081 0.443542 0.080051
N -3.561104 -0.012987 0.153211
N -1.226904 0.398928 0.099552
C -4.709177 -0.926699 -0.067973
C -3.853847 1.354083 0.633717
C -2.281133 -0.532901 -0.058672
C 0.162604 0.144855 0.041642
C -5.145095 -1.661538 1.216929
C -3.943886 2.407486 -0.497099
C 1.027877 1.254388 0.235348
C 0.726030 -1.141689 -0.191335
C 2.431503 1.102555 0.202526
C 3.013143 -0.182666 -0.025865
C 2.121089 -1.275257 -0.217956
C 4.475978 -0.395590 -0.065976
H -5.544404 -0.329000 -0.480680
H -4.405440 -1.663666 -0.829324
H -4.820637 1.314055 1.167679
H -3.110951 1.657218 1.398300
H -1.481544 1.376025 0.246349
H -4.322754 -2.298247 1.584219
H -5.426104 -0.952444 2.017809
H -6.018970 -2.306751 1.011477
H -2.992790 2.503883 -1.052412
H -4.722565 2.123631 -1.226610
H -4.204791 3.399236 -0.084061
H 0.602829 2.252373 0.418038
H 0.066415 -1.994138 -0.351445
H 2.562845 -2.258830 -0.395434
H 2.736907 3.024846 0.538502
H 5.782604 -1.835779 -0.320904


