%chk=000265077.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265077

0 1
O 1.575455 -2.101094 -0.027068
O 4.217755 -1.669348 -0.781709
N -0.633467 -1.195099 0.312032
N 1.924088 1.556162 0.180673
N 4.004901 0.605969 -0.533789
C -0.117720 0.172065 0.648440
C 1.328069 0.273148 0.244990
C -1.982383 -1.444027 0.916552
C 0.333329 -2.258478 0.710118
C 2.077631 -0.826327 -0.055695
C -2.993369 -0.454425 0.386352
C 3.274002 1.654221 -0.228577
C 3.513261 -0.736987 -0.493550
C -3.815930 0.250886 1.275879
C -3.131243 -0.259650 -0.996484
C 3.837004 3.035179 -0.288577
C -4.773582 1.142244 0.782031
C -4.086676 0.634880 -1.483315
C -4.910316 1.336139 -0.595616
H -0.235249 0.441213 1.722825
H -0.738245 0.892106 0.057686
H -1.965919 -1.437516 2.029464
H -2.302017 -2.470885 0.609946
H 0.596916 -2.279005 1.786183
H -0.011351 -3.248932 0.343159
H 1.364270 2.374983 0.388909
H -3.719289 0.105884 2.349588
H -2.481052 -0.804843 -1.684161
H 4.904288 3.002271 -0.589577
H 3.802928 3.545414 0.684052
H 3.324632 3.660674 -1.033714
H -5.415295 1.685165 1.474142
H -4.192142 0.783967 -2.557176
H -5.657385 2.029244 -0.977615


%chk=000265077-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000265077

0 1
O 1.401986 -2.104427 -0.228863
O 3.811729 -1.639342 -1.603519
N -0.606550 -1.112734 0.685620
N 2.021448 1.496796 0.308056
N 3.849312 0.622859 -0.953370
C -0.002597 0.190354 1.003297
C 1.362066 0.259853 0.345770
C -1.986246 -1.325767 1.154923
C 0.339542 -2.209213 0.805479
C 1.968113 -0.825274 -0.263347
C -2.992938 -0.405724 0.463418
C 3.252559 1.629564 -0.334478
C 3.258585 -0.684491 -0.992305
C -4.070263 0.154663 1.191408
C -2.885057 -0.138374 -0.924793
C 3.890164 3.000091 -0.296876
C -5.033291 0.963014 0.543399
C -3.842765 0.672088 -1.572844
C -4.921909 1.223758 -0.841508
H 0.082995 0.369210 2.108369
H -0.658479 0.985794 0.597546
H -2.082634 -1.199654 2.261446
H -2.243747 -2.380808 0.933230
H 0.874136 -2.230245 1.786919
H -0.158743 -3.171809 0.619643
H 1.587740 2.311734 0.747219
H -4.158880 -0.041930 2.267709
H -2.042195 -0.566338 -1.479822
H 4.849603 2.947335 -0.829588
H 4.078986 3.334683 0.740628
H 3.253949 3.758469 -0.791314
H -5.863728 1.389711 1.117145
H -3.751051 0.870643 -2.646704
H -5.665943 1.850710 -1.345494


