%chk=000291433.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291433

0 1
O -1.841993 -2.913302 -0.120476
O 3.419121 -3.019022 -0.179425
O 1.269186 -3.030993 -0.002996
O 4.958906 2.915316 -0.633129
O 5.949749 0.991509 -0.608002
N -0.112951 -0.838553 -0.258949
N -1.230658 -0.037464 -0.149770
N 2.344514 -2.447564 -0.151808
N 4.953724 1.695816 -0.577104
C 1.120141 -0.218870 -0.286431
C -2.431682 -0.537626 -0.155969
C -3.539297 0.452445 -0.023374
C 2.325290 -0.999165 -0.285568
C 1.242441 1.212001 -0.335261
C -2.899037 -1.967758 -0.330181
C 3.578215 -0.354483 -0.390600
C 3.651931 1.028219 -0.464471
C 2.465349 1.819425 -0.424480
C -3.846733 1.306676 -1.091221
C -4.275919 0.510257 1.168903
C -4.904849 2.212001 -0.967293
C -5.329719 1.420372 1.283814
C -5.646753 2.268325 0.216740
C -1.674852 -3.355293 1.245711
H 0.325833 1.813461 -0.301269
H -3.773770 -2.196579 0.305704
H -3.172472 -2.149692 -1.394352
H 4.500368 -0.965025 -0.407867
H -0.197872 -1.899532 -0.294111
H 2.562008 2.912767 -0.468851
H -3.259606 1.270194 -2.008338
H -4.022169 -0.140123 2.004116
H -5.148060 2.877504 -1.795305
H -5.903594 1.471706 2.208673
H -6.470028 2.975855 0.310345
H -1.558538 -2.510128 1.927406
H -2.513843 -3.994330 1.533089
H -0.740982 -3.939145 1.180603


%chk=000291433-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291433

0 1
O -1.716156 -2.936130 0.447642
O 3.532520 -3.106488 -0.535539
O 1.275729 -3.113158 -0.218844
O 5.000789 2.967849 -0.944812
O 6.048266 0.936092 -0.966588
N -0.081621 -0.854812 -0.264192
N -1.191668 -0.029740 -0.130826
N 2.408008 -2.488200 -0.414016
N 4.990085 1.674259 -0.885981
C 1.160958 -0.262857 -0.397751
C -2.398888 -0.584146 -0.110301
C -3.548158 0.349348 0.011960
C 2.385210 -1.024006 -0.489518
C 1.274153 1.166544 -0.463839
C -2.642164 -2.082884 -0.309098
C 3.634100 -0.387366 -0.652507
C 3.686652 1.009565 -0.716512
C 2.505831 1.796325 -0.617203
C -3.400128 1.716020 -0.368601
C -4.811570 -0.078252 0.511872
C -4.474181 2.617698 -0.254539
C -5.886397 0.829531 0.628623
C -5.725535 2.179393 0.244206
C -1.945538 -2.909531 1.899404
H 0.351826 1.743105 -0.381557
H -3.689659 -2.357025 -0.088683
H -2.442118 -2.340544 -1.367151
H 4.543950 -0.988571 -0.724104
H -0.143843 -1.892877 -0.159328
H 2.587953 2.885289 -0.664133
H -2.433652 2.047390 -0.759277
H -4.961490 -1.111796 0.841239
H -4.342285 3.661385 -0.559936
H -6.847591 0.482630 1.023004
H -6.562410 2.880870 0.329538
H -1.803951 -1.892195 2.317731
H -2.966204 -3.268199 2.141234
H -1.199424 -3.595312 2.326885


