%chk=000212369.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212369

0 1
O 0.156226 -0.472026 1.693603
N -2.983562 -2.437683 -0.127436
C 1.610447 -0.424139 -0.280077
C 0.154928 -0.265706 0.259976
C 2.538714 0.612877 0.382300
C 2.149281 -1.848823 -0.039144
C 3.985259 0.468349 -0.104994
C 3.593102 -1.991088 -0.538377
C 4.514244 -0.954579 0.118775
C -0.809586 -1.288741 -0.379724
C -0.356917 1.156651 0.070285
C -2.210103 -1.208891 0.250366
C -0.497114 1.683266 -1.222799
C -0.695072 1.945347 1.178664
C -0.971032 2.985648 -1.401176
C -1.169271 3.247076 0.995962
C -3.530700 -2.323995 -1.512786
C -4.093894 -2.673358 0.844356
C -1.308242 3.769926 -0.293342
H 1.592581 -0.234811 -1.380117
H 2.489092 0.498398 1.483567
H 2.174024 1.637014 0.171870
H 1.505814 -2.593461 -0.546829
H 2.105166 -2.085230 1.042826
H 4.629921 1.197325 0.420987
H 4.046828 0.726066 -1.179679
H 3.622799 -1.874025 -1.638777
H 3.962582 -3.012323 -0.328962
H 5.538559 -1.046800 -0.286608
H 4.593458 -1.157572 1.203991
H -0.866262 -1.127762 -1.471281
H -0.417682 -2.319705 -0.253633
H -2.710563 -0.262387 -0.043975
H -2.099051 -1.171410 1.359335
H 0.541176 -1.346308 1.907841
H -0.237628 1.081962 -2.091662
H -0.583103 1.532735 2.185086
H -1.077319 3.390152 -2.405842
H -1.429904 3.854209 1.860976
H -4.240593 -1.497695 -1.663677
H -4.035354 -3.266771 -1.776777
H -2.696104 -2.194652 -2.219323
H -3.663294 -2.835597 1.845641
H -4.622469 -3.599382 0.567817
H -4.832346 -1.861481 0.911206
H -1.676838 4.783500 -0.434634


%chk=000212369-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212369

0 1
O 0.194531 -0.538576 1.844664
N -3.080894 -2.403023 -0.052110
C 1.615103 -0.433657 -0.214210
C 0.158998 -0.300377 0.378410
C 2.580718 0.618486 0.392371
C 2.212164 -1.858711 -0.050587
C 4.003259 0.513895 -0.205803
C 3.635336 -1.960065 -0.654053
C 4.587787 -0.907739 -0.043267
C -0.818160 -1.329223 -0.269308
C -0.366105 1.132220 0.195140
C -2.273440 -1.186388 0.222445
C -0.547309 1.656211 -1.111189
C -0.680569 1.951397 1.305690
C -1.026977 2.969933 -1.303628
C -1.162770 3.266936 1.115058
C -3.300251 -2.636592 -1.494348
C -4.357282 -2.385754 0.693033
C -1.337569 3.783746 -0.188632
H 1.530711 -0.232432 -1.305005
H 2.621138 0.468351 1.489962
H 2.180641 1.635505 0.226801
H 1.562614 -2.616962 -0.526719
H 2.274748 -2.111627 1.030903
H 4.666606 1.259011 0.275043
H 3.966716 0.769780 -1.285737
H 3.574550 -1.801908 -1.751130
H 4.035022 -2.981406 -0.500094
H 5.586444 -0.972856 -0.517517
H 4.728502 -1.124115 1.036225
H -0.759608 -1.228363 -1.370478
H -0.489061 -2.357266 -0.021392
H -2.740045 -0.272370 -0.223625
H -2.251783 -1.038161 1.318319
H 0.457376 -1.482177 1.989466
H -0.316330 1.038170 -1.987736
H -0.541661 1.545071 2.310624
H -1.160328 3.357410 -2.320305
H -1.401017 3.887917 1.986530
H -3.846919 -1.796983 -1.997513
H -3.890461 -3.560456 -1.632395
H -2.335369 -2.774412 -2.011949
H -4.154045 -2.286935 1.774311
H -4.896309 -3.336886 0.530716
H -5.038077 -1.548274 0.392541
H -1.710424 4.803759 -0.335723


