%chk=000213574.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213574

0 1
O -0.162586 -1.732932 0.669159
O 2.723643 -1.353714 0.795789
O -2.576898 1.278508 0.308233
O -3.376632 -2.954928 0.869739
N -2.362884 -0.723208 -0.783772
C 1.639706 1.845896 -0.600062
C -0.351913 0.512813 -0.168438
C 0.242225 1.697534 -0.610945
C 0.454538 -0.542457 0.288048
C 1.858507 -0.400808 0.282132
C 2.448302 0.791159 -0.158484
C 2.260117 3.127451 -1.083862
C -1.850475 0.415365 -0.154031
C -3.793962 -1.068209 -0.642631
C 1.732298 4.330588 -0.353559
C -4.090950 -1.721523 0.719520
C -0.062311 -1.999386 2.099632
C 2.647763 -2.657485 0.155186
C 1.603717 5.528951 -0.918169
H -0.392672 2.521888 -0.949188
H 3.535166 0.875936 -0.140378
H 3.367406 3.104638 -0.968400
H 2.090491 3.221052 -2.180466
H -1.740688 -1.499598 -1.011881
H -4.072005 -1.756206 -1.471637
H -4.408473 -0.141935 -0.753671
H 1.471709 4.154327 0.692582
H -5.149176 -2.034540 0.797045
H -3.839650 -1.047788 1.559343
H -0.480494 -3.008044 2.183989
H 0.986520 -1.973674 2.418927
H -0.661715 -1.264290 2.644932
H 3.032443 -2.577227 -0.865170
H 1.622039 -3.041943 0.166340
H 3.312328 -3.259482 0.785146
H 1.845503 5.743918 -1.948356
H 1.239742 6.395329 -0.383809
H -2.408378 -2.784272 0.879466


%chk=000213574-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000213574

0 1
O -0.256995 -1.730513 0.807579
O 2.633523 -1.534198 0.783138
O -2.593664 1.433692 0.374616
O -3.015585 -2.925405 0.691588
N -2.412390 -0.575202 -0.799561
C 1.703254 1.861189 -0.446264
C -0.366105 0.558465 -0.115635
C 0.292973 1.754856 -0.483748
C 0.397317 -0.552311 0.336459
C 1.818741 -0.468951 0.336169
C 2.453867 0.730970 -0.042404
C 2.409985 3.148751 -0.873757
C -1.878736 0.521367 -0.144552
C -3.818756 -0.985114 -0.645413
C 1.718836 4.415518 -0.403154
C -3.976070 -1.816191 0.652676
C -0.035903 -1.998550 2.260541
C 2.534236 -2.782528 -0.009482
C 1.328871 5.431697 -1.212249
H -0.316708 2.614280 -0.782452
H 3.548679 0.760354 -0.008546
H 3.446770 3.128280 -0.481216
H 2.495606 3.176741 -1.978746
H -1.761828 -1.257690 -1.192737
H -4.102316 -1.589230 -1.524651
H -4.451416 -0.081766 -0.603877
H 1.539773 4.487018 0.680276
H -4.974942 -2.281079 0.697112
H -3.851274 -1.147586 1.529441
H -0.571904 -2.936759 2.469362
H 1.042270 -2.104513 2.466320
H -0.463663 -1.173243 2.857402
H 2.867949 -2.598474 -1.048081
H 1.501396 -3.174087 -0.008851
H 3.215439 -3.493068 0.482270
H 1.479724 5.392868 -2.298753
H 0.847004 6.330582 -0.812412
H -2.095657 -2.538466 0.659891


