%chk=000288953.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288953

0 1
O 0.832807 1.156703 2.054801
N -1.091310 -1.449034 -0.700714
C 0.293705 0.101954 -0.060159
C -1.171955 -0.312177 0.300141
C 0.371732 -1.162191 -0.953021
C -1.477336 -2.819942 -0.238354
C 1.253777 0.141731 1.131538
C -2.208893 0.731879 -0.011470
C -0.721866 -3.284827 1.026944
C -2.990515 -2.788769 0.048459
C -1.179206 -3.787464 -1.400575
C 2.685946 0.370236 0.689890
C -2.344591 1.807485 0.883550
C -3.022069 0.668475 -1.149269
C 3.650397 -0.615006 0.942495
C 3.057853 1.553087 0.035456
C -3.291128 2.803812 0.640510
C -3.971095 1.668238 -1.386351
C -4.107889 2.735334 -0.494339
C 4.975269 -0.418519 0.541577
C 4.383809 1.747788 -0.360977
C 5.344145 0.762448 -0.109813
H 0.340810 1.044023 -0.637328
H -1.282099 -0.641965 1.359368
H 0.542029 -0.965120 -2.024108
H 1.087713 -1.926761 -0.619988
H 1.159257 -0.775760 1.763814
H -0.909524 -2.621453 1.877458
H -1.041204 -4.288356 1.325869
H 0.358692 -3.324229 0.865177
H -3.367617 -3.783170 0.302055
H -3.238418 -2.116215 0.876450
H -3.548031 -2.431744 -0.826889
H -0.106959 -3.879545 -1.595266
H -1.566641 -4.788407 -1.190059
H -1.648313 -3.436987 -2.328881
H -1.707508 1.859190 1.767391
H -2.907672 -0.162665 -1.848468
H 0.919831 2.050511 1.666146
H 3.374055 -1.533913 1.457016
H 2.316912 2.323530 -0.169728
H -3.396084 3.634234 1.335787
H -4.603388 1.613767 -2.270406
H -4.846783 3.511176 -0.680546
H 5.721452 -1.186309 0.740469
H 4.668871 2.668768 -0.867418
H 6.376332 0.915360 -0.419633


%chk=000288953-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000288953

0 1
O 0.918146 1.130340 2.008345
N -1.047510 -1.527417 -0.708376
C 0.427105 -0.084815 -0.092771
C -1.041022 -0.453587 0.355243
C 0.445554 -1.442469 -0.871961
C -1.725507 -2.846697 -0.496120
C 1.432988 0.118744 1.045589
C -2.101962 0.628265 0.256748
C -1.216016 -3.607393 0.767149
C -3.244673 -2.583344 -0.356406
C -1.453744 -3.700140 -1.759322
C 2.858466 0.468494 0.604101
C -2.469525 1.368032 1.409955
C -2.698844 0.953027 -0.986816
C 3.791123 0.888384 1.589555
C 3.287927 0.375329 -0.743569
C -3.418131 2.411700 1.321827
C -3.648690 1.994469 -1.076730
C -4.011716 2.728890 0.077277
C 5.119406 1.206966 1.236416
C 4.619055 0.694411 -1.099599
C 5.539219 1.110626 -0.112144
H 0.422873 0.786940 -0.772242
H -1.015383 -0.850904 1.395091
H 0.786708 -1.424083 -1.922757
H 1.022634 -2.221071 -0.323608
H 1.455941 -0.796573 1.669140
H -1.422315 -3.038461 1.692356
H -1.728555 -4.582654 0.854452
H -0.129316 -3.806111 0.713870
H -3.789027 -3.537663 -0.234687
H -3.463755 -1.949298 0.521680
H -3.629560 -2.064897 -1.251440
H -0.373815 -3.907201 -1.880081
H -1.978395 -4.670461 -1.691213
H -1.806956 -3.168276 -2.660434
H -2.001906 1.127264 2.372388
H -2.415992 0.362171 -1.865697
H 0.850869 2.000861 1.536695
H 3.456615 0.972435 2.629446
H 2.589135 0.054188 -1.523175
H -3.696744 2.974415 2.220501
H -4.109094 2.232842 -2.042793
H -4.750483 3.535737 0.008591
H 5.826586 1.530758 2.008534
H 4.935240 0.619039 -2.146245
H 6.570348 1.358386 -0.388161


