%chk=000225516.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225516

0 1
N 4.453779 -0.293408 -0.101310
N -0.544030 1.657506 -0.028862
N -4.514360 0.218114 -0.725560
C 1.518283 1.727888 1.328705
C -0.006174 1.483790 1.360461
C 2.262606 0.598313 0.609581
C 3.778431 0.862113 0.576329
C -0.681675 2.439224 2.357832
C -1.884377 1.193732 -0.244932
C 5.758057 0.116931 -0.720162
C 4.638597 -1.440932 0.849596
C -2.137052 -0.229901 -0.243033
C -2.930945 2.065393 -0.535404
C -3.473482 -0.666468 -0.460789
C 5.500495 0.935490 -1.986490
C 4.853038 -2.737465 0.066553
C -1.118710 -1.215909 -0.078266
C -4.233090 1.514571 -0.779810
C -2.761407 3.546881 -0.599269
C -1.425431 -2.558670 -0.070453
C -3.780789 -2.067463 -0.431202
C -2.783537 -2.984277 -0.233366
C -0.364946 -3.598264 0.096713
H 1.888506 1.821586 2.368303
H 1.742547 2.697214 0.843789
H -0.208386 0.428227 1.683946
H 1.885540 0.490810 -0.430429
H 2.055141 -0.373256 1.098082
H 3.973225 1.788922 -0.007420
H 4.165493 1.050471 1.599721
H -0.406076 2.619507 -0.357037
H -0.460680 3.489615 2.146425
H -1.772788 2.320991 2.344341
H -0.352813 2.238220 3.383458
H 6.408165 0.685014 -0.020788
H 6.317240 -0.806427 -0.994313
H 5.475709 -1.280735 1.562588
H 3.714057 -1.537257 1.463077
H 4.796950 0.412484 -2.649770
H 5.056176 1.911561 -1.762138
H 6.427474 1.104453 -2.542392
H 4.076199 -2.860940 -0.700931
H 5.816331 -2.746491 -0.455969
H 4.819357 -3.608303 0.727836
H -0.082719 -0.882586 0.010144
H -5.067062 2.189876 -1.011994
H -2.239785 3.940401 0.284173
H -2.192123 3.843521 -1.492814
H -3.725044 4.072875 -0.652721
H -4.820161 -2.366650 -0.576979
H -3.004778 -4.050311 -0.208625
H -0.360991 -4.301975 -0.748229
H 0.644048 -3.168442 0.156812
H -0.524136 -4.185563 1.011793


%chk=000225516-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225516

0 1
N 4.478109 -0.247623 -0.129061
N -0.599753 1.702820 0.199373
N -4.457419 0.232631 -1.015129
C 1.500586 1.624778 1.537001
C -0.037383 1.451329 1.563049
C 2.238405 0.561182 0.696854
C 3.756517 0.824765 0.604177
C -0.694988 2.388141 2.608682
C -1.847069 1.198859 -0.227862
C 5.694639 0.240785 -0.832075
C 4.744660 -1.440784 0.719169
C -2.135397 -0.223837 -0.215935
C -2.837433 2.077500 -0.740591
C -3.472725 -0.645635 -0.577715
C 5.370101 1.025999 -2.117416
C 4.851619 -2.743789 -0.096753
C -1.155702 -1.231489 0.066713
C -4.101964 1.528514 -1.116050
C -2.604368 3.572208 -0.846798
C -1.476482 -2.594840 0.081072
C -3.796757 -2.039836 -0.525296
C -2.830964 -2.987740 -0.191064
C -0.421714 -3.653082 0.352805
H 1.870443 1.601932 2.582053
H 1.736692 2.639997 1.148455
H -0.279580 0.410016 1.835792
H 1.820177 0.532183 -0.325927
H 2.063193 -0.439653 1.143018
H 3.912255 1.778950 0.066424
H 4.176720 0.973461 1.633353
H -0.429758 2.671048 -0.095714
H -0.431109 3.445877 2.411768
H -1.795357 2.292253 2.581623
H -0.352680 2.139663 3.630404
H 6.335265 0.865221 -0.157027
H 6.301155 -0.641582 -1.106807
H 5.668872 -1.302775 1.337206
H 3.907292 -1.542619 1.434326
H 4.788707 0.392858 -2.809821
H 4.775120 1.933910 -1.908310
H 6.301267 1.345576 -2.622094
H 3.918623 -2.911825 -0.662640
H 5.684539 -2.707774 -0.822259
H 5.026449 -3.608402 0.571067
H -0.114820 -0.930178 0.215360
H -4.878773 2.210491 -1.488583
H -2.344298 4.021485 0.132619
H -1.789052 3.824045 -1.555377
H -3.513533 4.079610 -1.212266
H -4.822813 -2.322335 -0.781277
H -3.093306 -4.052800 -0.166317
H -0.350563 -4.372862 -0.484593
H 0.576688 -3.204262 0.496485
H -0.664434 -4.238364 1.260711


