%chk=000268098.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268098

0 1
O -2.990071 -1.932426 -0.129219
O 2.990007 -1.932984 0.129623
O -4.186561 0.010600 0.055492
O 4.186931 0.009707 -0.055643
N -1.849775 0.038052 -0.193131
N 1.850139 0.037782 0.192879
C -0.599981 -0.457303 0.452053
C 0.600243 -0.457654 -0.452051
C -1.205747 0.892253 0.858530
C 1.206277 0.891572 -0.859219
C -0.587687 2.165148 0.387726
C 0.588475 2.164831 -0.389063
C -3.129428 -0.564967 -0.035488
C 3.129664 -0.565583 0.035523
C -1.180717 3.383252 0.750924
C 1.181751 3.382630 -0.752883
C -0.592115 4.591196 0.369928
C 0.593393 4.590887 -0.372504
C -4.217399 -2.727482 -0.229495
C 4.217183 -2.728233 0.230241
C -4.895858 -2.811847 1.120465
C 4.895262 -2.813679 -1.119841
H -0.629844 -1.309744 1.149712
H 0.629937 -1.310457 -1.149277
H -1.690031 0.975403 1.846616
H 1.690573 0.974122 -1.847350
H -2.106384 3.388831 1.326829
H 2.107418 3.387727 -1.328791
H -1.057159 5.534598 0.653854
H 1.058628 5.534050 -0.656911
H -4.862110 -2.277328 -1.005028
H -3.800500 -3.692434 -0.573479
H 4.862199 -2.277662 1.005278
H 3.800167 -3.692844 0.575030
H -5.739460 -3.512473 1.101763
H -4.203671 -3.143826 1.904252
H -5.291895 -1.830986 1.428137
H 5.738968 -3.514170 -1.100771
H 4.202893 -3.146425 -1.903142
H 5.291086 -1.833036 -1.428467


%chk=000268098-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268098

0 1
O -3.092272 -1.859748 -0.394313
O 3.091822 -1.860378 0.393843
O -4.177742 0.104350 0.326818
O 4.177830 0.103234 -0.327701
N -1.867696 0.059185 -0.160945
N 1.867608 0.058566 0.159117
C -0.600518 -0.422020 0.450811
C 0.600273 -0.422175 -0.452655
C -1.195650 0.928486 0.865953
C 1.195845 0.928175 -0.867689
C -0.574309 2.216942 0.418867
C 0.574930 2.216794 -0.420480
C -3.137496 -0.509658 -0.015983
C 3.137207 -0.510690 0.014104
C -1.135071 3.446131 0.833283
C 1.136107 3.445839 -0.834761
C -0.568416 4.671827 0.418231
C 0.569866 4.671681 -0.419574
C -4.406283 -2.571725 -0.388912
C 4.405874 -2.572293 0.390048
C -4.732091 -3.111398 1.006325
C 4.732391 -3.113769 -1.004324
H -0.667857 -1.253099 1.163803
H 0.667349 -1.253218 -1.165715
H -1.703504 0.963327 1.838540
H 1.703708 0.962938 -1.840275
H -2.024527 3.443231 1.473899
H 2.025562 3.442709 -1.475377
H -1.012230 5.618736 0.743772
H 1.014000 5.618476 -0.745011
H -5.185106 -1.872295 -0.740214
H -4.261741 -3.380120 -1.123547
H 5.184492 -1.872368 0.740818
H 4.261018 -3.379741 1.125661
H -5.660148 -3.711694 0.967369
H -3.919337 -3.759159 1.378741
H -4.888872 -2.283324 1.717852
H 5.660413 -3.714036 -0.964110
H 3.919815 -3.761995 -1.376319
H 4.889558 -2.286626 -1.716848


