%chk=000217010.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217010

0 1
N 2.267858 0.176405 0.455202
N 0.455311 -1.309140 0.153662
N -1.238033 -2.880800 -0.130621
C 4.353863 1.083613 -0.401239
C 4.590795 -0.373131 0.034940
C 2.945247 1.459436 0.093319
C 3.200411 -0.982409 0.281469
C 0.898011 0.015729 0.226644
C 0.008074 1.097116 0.193306
C -1.380324 0.854074 0.084360
C -1.865737 -0.483673 -0.001424
C -0.872673 -1.536132 0.033942
C -2.330353 1.931228 0.054928
C -3.264727 -0.714230 -0.130030
C -3.671369 1.674184 -0.061588
C -4.150812 0.334961 -0.157800
H 5.119018 1.758127 0.017000
H 4.419387 1.176322 -1.500011
H 5.146452 -0.938546 -0.730991
H 5.200095 -0.408075 0.955863
H 2.989323 2.086391 1.010606
H 2.381637 2.027277 -0.675308
H 2.884610 -1.640306 -0.556936
H 3.162309 -1.594552 1.206987
H 0.359912 2.116945 0.274010
H -1.957017 2.950178 0.126800
H -3.628981 -1.737693 -0.213205
H -4.395228 2.488859 -0.084305
H -5.219177 0.164874 -0.255552
H -0.521827 -3.575959 0.042415
H -2.163357 -3.158275 0.154354


%chk=000217010-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217010

0 1
N 2.281008 0.142695 -0.034466
N 0.448830 -1.310285 -0.015598
N -1.247137 -2.883155 0.002647
C 4.454591 1.072478 -0.293030
C 4.571007 -0.333279 0.353582
C 2.967363 1.448742 -0.074026
C 3.220246 -1.002066 0.006738
C 0.905683 0.000492 -0.011452
C 0.024209 1.107232 0.015865
C -1.381795 0.870191 0.031671
C -1.881089 -0.490503 0.024094
C -0.878586 -1.546467 0.004344
C -2.342045 1.941056 0.057557
C -3.289028 -0.726987 0.037887
C -3.713757 1.681181 0.072649
C -4.199957 0.336147 0.062003
H 5.141838 1.812419 0.151027
H 4.670556 1.009398 -1.375468
H 5.432798 -0.908931 -0.024931
H 4.675285 -0.238810 1.450380
H 2.823025 2.003605 0.878362
H 2.573728 2.083719 -0.892436
H 3.256090 -1.517576 -0.974913
H 2.890414 -1.744595 0.752326
H 0.399332 2.133521 0.033606
H -1.975448 2.974680 0.064878
H -3.682174 -1.751539 0.029067
H -4.427691 2.512854 0.092139
H -5.277883 0.142902 0.072821
H -0.501055 -3.574189 -0.017134
H -2.215658 -3.182130 0.020609


