%chk=000207851.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207851

1 1
O 0.760144 0.544017 -1.476721
N -2.799763 0.350845 0.033412
C -1.445396 -0.366637 -0.066836
C 1.039531 0.082101 -0.131360
C 2.240047 0.876416 0.457319
C -3.830610 -0.499192 -0.726370
C -3.207888 0.440128 1.511027
C -0.293209 0.379552 0.609912
C -2.719922 1.765537 -0.566840
C -5.257603 0.027405 -0.558630
C -4.633463 0.966063 1.697060
C 1.987863 2.396353 0.408828
C 3.532985 0.524260 -0.308036
C -5.651095 0.131769 0.916139
C 3.190230 3.175964 0.958176
C 4.733736 1.310606 0.232111
C 1.300295 -1.418671 -0.155531
C 4.477432 2.821964 0.203437
C -2.185126 1.786165 -1.985448
C 1.616214 -2.093081 1.033621
C 1.219297 -2.134747 -1.356505
C 1.851048 -3.470147 1.016571
C 1.456339 -3.512641 -1.370631
C 1.771797 -4.182563 -0.185118
H -1.538958 -1.391522 0.359697
H -1.199180 -0.503689 -1.155737
H 2.373723 0.573055 1.524742
H -3.770700 -1.548876 -0.354162
H -3.551821 -0.523520 -1.806082
H -2.483037 1.088494 2.052994
H -3.121259 -0.576775 1.962436
H -0.193569 0.089184 1.673263
H -0.449595 1.480336 0.595581
H -2.062281 2.384946 0.090723
H -3.738853 2.219661 -0.527738
H -5.381988 1.007781 -1.063606
H -5.956690 -0.656378 -1.090801
H -4.882506 0.947724 2.782179
H -4.707288 2.034543 1.409179
H 1.083846 2.657122 0.989224
H 1.785965 2.710315 -0.634519
H 3.402351 0.736906 -1.388047
H 3.740082 -0.562140 -0.230907
H -6.661782 0.584322 1.007557
H -5.748275 -0.878732 1.363476
H 2.997523 4.263591 0.883651
H 3.319592 2.964637 2.037523
H 4.962515 0.987357 1.266639
H 5.636073 1.069330 -0.363418
H 5.336951 3.358898 0.649987
H 4.413265 3.176001 -0.843445
H -1.133773 1.438950 -2.052714
H -2.178591 2.817918 -2.376481
H -2.780314 1.195607 -2.692135
H 1.603907 0.700042 -1.966947
H 1.696640 -1.548716 1.973253
H 0.978582 -1.615975 -2.285539
H 2.105300 -3.990421 1.940936
H 1.402537 -4.064048 -2.310058
H 1.962922 -5.256398 -0.197089


%chk=000207851-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207851

1 1
O 0.892542 0.600485 -1.682869
N -2.829803 0.402361 -0.049752
C -1.421987 -0.211647 -0.240227
C 1.082166 0.169305 -0.274958
C 2.311387 0.914782 0.361941
C -3.836156 -0.552155 -0.740704
C -3.157553 0.453187 1.460622
C -0.266465 0.588317 0.385310
C -2.909571 1.828365 -0.653358
C -5.305942 -0.192748 -0.471853
C -4.620053 0.827586 1.755682
C 2.134990 2.453363 0.463647
C 3.626365 0.574244 -0.396203
C -5.606545 -0.124608 1.042817
C 3.373048 3.127705 1.107507
C 4.855757 1.237237 0.269925
C 1.258414 -1.365897 -0.190417
C 4.679819 2.769193 0.365046
C -2.402397 1.954481 -2.094968
C 1.449742 -1.992485 1.070299
C 1.205323 -2.178478 -1.349514
C 1.597304 -3.393443 1.166079
C 1.359895 -3.581682 -1.256254
C 1.556408 -4.195081 0.000928
H -1.473011 -1.227662 0.186864
H -1.260762 -0.301451 -1.325519
H 2.423536 0.519117 1.393757
H -3.610775 -1.557322 -0.341356
H -3.595367 -0.548423 -1.815953
H -2.452449 1.166332 1.918016
H -2.933097 -0.557681 1.847439
H -0.202512 0.425426 1.475582
H -0.385675 1.668369 0.200217
H -2.329480 2.478471 0.022531
H -3.963710 2.135478 -0.582875
H -5.580423 0.757180 -0.967611
H -5.923172 -0.974232 -0.951915
H -4.755000 0.771673 2.851494
H -4.821698 1.878486 1.477233
H 1.244142 2.708831 1.070680
H 1.967829 2.869406 -0.550849
H 3.571818 0.953596 -1.442144
H 3.765949 -0.521225 -0.451029
H -6.644550 0.210962 1.209041
H -5.525711 -1.138655 1.482510
H 3.229532 4.224742 1.124582
H 3.456275 2.801096 2.164892
H 4.990507 0.816139 1.287336
H 5.768941 0.987031 -0.301615
H 5.546239 3.222827 0.881424
H 4.655166 3.201192 -0.656580
H -1.327566 1.727798 -2.193896
H -2.550580 3.003651 -2.407589
H -2.970614 1.329322 -2.805287
H 1.766646 0.564134 -2.147735
H 1.499369 -1.391024 1.986581
H 1.043000 -1.713112 -2.327439
H 1.754094 -3.858620 2.145400
H 1.329524 -4.192668 -2.165069
H 1.681094 -5.280574 0.073357


