%chk=000183675.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183675

0 1
O -4.444810 1.294043 0.141747
N -1.192937 -0.174024 -0.869972
N 1.585802 0.748482 -0.449634
C -0.163330 0.459277 1.352087
C 0.676362 -1.533688 0.153207
C -1.411497 0.529729 0.426844
C 1.864022 -0.719259 -0.434210
C 0.287044 -0.996381 1.537394
C -0.569267 -1.527756 -0.762689
C 1.024748 1.295533 0.823459
C -2.653209 0.026897 1.209800
C 3.168137 -1.097897 0.319109
C -2.430925 -0.193352 -1.698932
C 2.777262 1.522788 -0.906790
C -3.922441 -0.027178 0.351433
C 4.367415 -0.303843 -0.209846
C -3.686261 -0.729793 -0.992376
C 4.086492 1.202789 -0.163220
H -0.452363 0.888194 2.342601
H 1.009149 -2.596101 0.247366
H -1.580018 1.606154 0.152510
H 1.983794 -1.003470 -1.514293
H 1.140054 -1.056181 2.237407
H -0.519396 -1.605909 1.983194
H -0.268742 -1.820872 -1.793666
H -1.282535 -2.298851 -0.398040
H 0.677756 2.328888 0.599475
H 1.787804 1.375399 1.628544
H -2.452602 -0.978835 1.623978
H -2.836695 0.687348 2.078214
H 3.359771 -2.180357 0.218155
H 3.043541 -0.907022 1.401591
H -2.235900 -0.776517 -2.623873
H -2.606248 0.854471 -2.034264
H 2.549398 2.606577 -0.837675
H 2.897631 1.301228 -1.991783
H -4.761116 -0.505079 0.910911
H 4.595259 -0.611458 -1.248802
H 5.269460 -0.541374 0.383969
H -4.571890 -0.586482 -1.640955
H -3.598920 -1.819263 -0.829715
H 4.021459 1.543538 0.886544
H 4.923771 1.763895 -0.615206
H -3.810328 1.847212 -0.353800


%chk=000183675-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183675

0 1
O -4.372686 1.489259 -0.011353
N -1.216897 -0.294474 -0.799311
N 1.600155 0.738091 -0.322502
C -0.191382 0.412478 1.403334
C 0.706639 -1.566936 0.196305
C -1.423335 0.472368 0.456574
C 1.874296 -0.721755 -0.389506
C 0.291003 -1.044316 1.591167
C -0.561829 -1.609896 -0.691549
C 1.018300 1.254193 0.928248
C -2.728950 0.045567 1.203563
C 3.241814 -1.099291 0.269156
C -2.385526 -0.234022 -1.698334
C 2.702360 1.544712 -0.885308
C -3.967757 0.089890 0.276295
C 4.396317 -0.250552 -0.320546
C -3.710961 -0.700862 -1.029596
C 4.078325 1.261268 -0.218840
H -0.513957 0.830534 2.378405
H 1.074449 -2.609817 0.280773
H -1.545678 1.539958 0.155850
H 1.962327 -0.972043 -1.471480
H 1.136412 -1.071408 2.304619
H -0.505055 -1.686779 2.014078
H -0.294497 -1.938646 -1.716090
H -1.229403 -2.408054 -0.264730
H 0.702837 2.301841 0.747368
H 1.746866 1.285442 1.783964
H -2.617560 -0.983145 1.600081
H -2.907466 0.718857 2.063800
H 3.441630 -2.177757 0.106921
H 3.192660 -0.940763 1.365453
H -2.174261 -0.842213 -2.597359
H -2.503373 0.814368 -2.052395
H 2.434689 2.614943 -0.797051
H 2.783932 1.312705 -1.968870
H -4.852446 -0.309916 0.801399
H 4.531941 -0.516953 -1.390449
H 5.349315 -0.487203 0.190508
H -4.565340 -0.557831 -1.717547
H -3.646917 -1.781191 -0.790909
H 4.049406 1.567871 0.846319
H 4.870072 1.860438 -0.710343
H -3.625769 1.942539 -0.480314


