%chk=000244147.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244147

0 1
O 3.238260 2.160758 0.125614
O -4.094672 -0.145267 0.627682
N 0.191465 -2.399535 -0.482716
N -2.747972 1.509327 -0.185285
N -3.683699 1.897551 -1.186560
C -0.833047 -0.759422 0.732801
C 0.464468 -0.272027 0.346107
C 1.094679 -1.313986 -0.414608
C -0.976263 -2.051049 0.213482
C -1.844747 -0.029573 1.529415
C 1.146204 0.941309 0.564495
C 2.387778 -1.170774 -0.955663
C -2.124489 -2.972794 0.317826
C 2.416928 1.056545 0.020858
C 3.047772 0.019640 -0.735805
C -2.996029 0.388067 0.633618
C 2.743828 3.301409 0.866288
H 0.363151 -3.264685 -0.955402
H -1.395974 0.846231 2.044160
H -2.246026 -0.675652 2.344501
H 0.680663 1.728578 1.142014
H 2.845032 -1.974563 -1.526924
H -2.039539 -3.625500 1.200949
H -3.073168 -2.409104 0.433926
H -2.249410 -3.616817 -0.562519
H 4.048263 0.201932 -1.123390
H -1.787038 1.746063 -0.463654
H 3.584744 4.002615 0.786705
H 2.559603 3.027060 1.908863
H 1.848850 3.707231 0.386197
H -4.198434 1.075828 -1.539409
H -4.396180 2.493206 -0.740465


%chk=000244147-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244147

0 1
O 3.121060 2.287260 0.173675
O -3.627124 1.659205 1.430239
N 0.227039 -2.447529 -0.465992
N -2.682767 0.945892 -0.569458
N -3.454422 1.808625 -1.396053
C -0.884647 -0.841801 0.715314
C 0.417535 -0.318415 0.330222
C 1.092469 -1.345574 -0.409572
C -0.967206 -2.151387 0.212997
C -1.916909 -0.115039 1.537897
C 1.061368 0.930357 0.552882
C 2.392112 -1.160273 -0.930631
C -2.068963 -3.168593 0.308230
C 2.359734 1.109069 0.032001
C 3.019340 0.075719 -0.702681
C -2.811547 0.911910 0.808647
C 2.508930 3.392573 0.909265
H 0.428472 -3.333575 -0.924434
H -1.436344 0.444346 2.362953
H -2.610522 -0.822024 2.030510
H 0.551552 1.720196 1.112390
H 2.906864 -1.945550 -1.494847
H -1.717921 -4.112330 0.768492
H -2.897190 -2.786011 0.926196
H -2.488675 -3.418910 -0.685586
H 4.025571 0.279285 -1.080505
H -2.007558 0.342516 -1.043580
H 3.256506 4.199512 0.895686
H 2.287217 3.108143 1.957136
H 1.577834 3.738709 0.418067
H -4.458567 1.642673 -1.233862
H -3.228241 2.793623 -1.192497


