%chk=000247978.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247978

0 1
O -1.270496 1.078268 1.792930
O -1.609944 -2.400195 -0.548219
O -4.138107 1.626581 -0.759124
O 5.110839 -0.893796 -0.699045
O 5.076548 1.258901 -0.498456
N -3.370674 -0.277476 0.231309
N 4.545564 0.160916 -0.454469
C -1.983542 -0.070438 -0.246076
C -1.037084 -0.092624 0.992350
C 0.425165 -0.013335 0.606225
C -1.618351 -1.154089 -1.277873
C 1.128546 -1.199246 0.335597
C 1.073953 1.227424 0.534798
C -4.399692 0.604074 -0.153193
C 2.476385 -1.146929 -0.010167
C 2.424276 1.291442 0.191210
C 3.115543 0.101825 -0.083672
C -5.775005 0.199452 0.287346
H -1.912860 0.945923 -0.737356
H -1.235254 -0.989897 1.627530
H -0.612783 -0.989809 -1.708222
H -2.364146 -1.206047 -2.091055
H -3.572709 -1.210890 0.587459
H 0.610606 -2.161816 0.392857
H 0.514334 2.139260 0.771677
H -2.232210 1.208295 1.945376
H 3.041979 -2.060541 -0.221629
H 2.946763 2.252791 0.135310
H -1.584064 -3.152748 -1.171743
H -6.493753 1.006435 0.061079
H -6.131904 -0.698926 -0.233999
H -5.839025 0.009012 1.367144


%chk=000247978-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247978

0 1
O -1.382695 0.917122 1.867824
O -1.936594 -2.615366 -0.443119
O -3.961139 1.778197 -0.743253
O 5.242417 -0.726285 -0.700013
O 5.038168 1.544093 -0.624594
N -3.365002 -0.275905 0.186438
N 4.557932 0.351649 -0.498464
C -1.958712 -0.218035 -0.253581
C -1.023091 -0.211905 1.008248
C 0.442885 -0.060829 0.639675
C -1.669759 -1.378717 -1.212675
C 1.245716 -1.211324 0.427628
C 1.013747 1.228333 0.487879
C -4.296557 0.709550 -0.152338
C 2.596982 -1.086500 0.053186
C 2.363535 1.372634 0.114425
C 3.135972 0.209811 -0.102686
C -5.736729 0.410205 0.249304
H -1.836436 0.744071 -0.785255
H -1.173461 -1.172671 1.543029
H -0.618056 -1.347429 -1.555557
H -2.344651 -1.306420 -2.088474
H -3.687436 -1.187981 0.522998
H 0.805909 -2.206126 0.565068
H 0.392881 2.104712 0.692842
H -2.373667 0.956863 1.913339
H 3.236432 -1.957544 -0.111266
H 2.826936 2.355270 -0.006939
H -1.891905 -3.401148 -1.041116
H -6.127800 1.252677 0.844543
H -6.358067 0.342371 -0.660905
H -5.848856 -0.521575 0.829707


