%chk=000249166.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249166

0 1
O 0.055079 -1.735412 -1.118479
O 7.280811 0.809051 1.497105
O -7.594191 -0.639027 0.985401
O 6.697213 -2.342201 0.651590
O -6.233973 2.093098 2.145315
N 0.378658 -0.580190 -0.801196
N -0.405943 0.398942 -0.534628
C 4.575938 0.152762 -0.590395
C -4.630502 0.436978 -0.548579
C 1.824798 -0.289613 -0.715948
C 6.054813 0.393982 -0.526396
C 3.682106 1.193844 -0.297266
C 4.084042 -1.116113 -0.941699
C -6.129762 0.502667 -0.540391
C -1.832448 0.313049 -0.565795
C 2.304238 0.980743 -0.359771
C 2.712035 -1.341973 -1.008290
C -3.872441 1.576005 -0.221491
C -3.981240 -0.758798 -0.880129
C -2.483147 1.522387 -0.228804
C -2.586397 -0.827339 -0.890979
C 6.634739 0.048617 0.825727
C -6.707167 0.155738 0.810549
C 6.367023 -1.394664 1.316686
C -6.081836 0.906294 2.008210
H 6.299756 1.452554 -0.775795
H 6.589948 -0.207083 -1.301660
H 4.059871 2.179470 -0.020078
H 4.778059 -1.930930 -1.165289
H -6.486369 1.520950 -0.825392
H -6.562769 -0.170726 -1.315237
H 1.608514 1.796575 -0.133521
H 2.314234 -2.327003 -1.285328
H -4.375701 2.508614 0.040822
H -4.561337 -1.646579 -1.134721
H -1.891527 2.404448 0.021881
H -2.086004 -1.766316 -1.153580
H 5.877157 -1.462652 2.299286
H -5.511779 0.269951 2.701463


%chk=000249166-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249166

0 1
O 0.016727 -1.805430 -1.260886
O 6.719115 1.014722 1.753647
O -7.072494 -1.113460 1.061492
O 6.893281 -2.315026 0.541506
O -6.410280 2.264725 1.918653
N 0.388912 -0.594922 -0.879794
N -0.392761 0.426149 -0.562935
C 4.619865 0.089292 -0.640092
C -4.651758 0.497307 -0.540281
C 1.835615 -0.333631 -0.788260
C 6.129260 0.325222 -0.540520
C 3.713705 1.132191 -0.311153
C 4.104967 -1.172577 -1.031881
C -6.179648 0.577536 -0.498984
C -1.800564 0.311327 -0.597920
C 2.322442 0.931038 -0.384970
C 2.714893 -1.389101 -1.112738
C -3.852122 1.616550 -0.182816
C -4.008667 -0.711933 -0.909673
C -2.452986 1.525842 -0.216367
C -2.604975 -0.821481 -0.947954
C 6.586334 0.100305 0.898894
C -6.673438 0.061965 0.850622
C 6.884252 -1.346529 1.335319
C -6.664214 1.043839 2.036920
H 6.381823 1.361430 -0.820680
H 6.663654 -0.379790 -1.200041
H 4.101619 2.107487 0.003557
H 4.796614 -1.987972 -1.269675
H -6.504852 1.624789 -0.623373
H -6.627306 -0.048959 -1.288241
H 1.613878 1.724391 -0.139877
H 2.297420 -2.351481 -1.417736
H -4.335013 2.550662 0.124085
H -4.616958 -1.584407 -1.175674
H -1.824662 2.381417 0.049911
H -2.126417 -1.755063 -1.240833
H 7.117262 -1.443840 2.422871
H -6.938021 0.567520 3.009073


