%chk=000203052.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203052

2 1
N 0.522254 1.043272 0.000331
N 4.133645 -0.535482 -0.010400
C -1.630839 0.326953 0.776802
C -1.557021 0.086593 -0.757824
C -0.151993 0.224687 1.156362
C -0.538324 1.150471 -1.163818
C -2.831303 -0.509119 1.306888
C -3.013059 -0.071798 -1.277318
C -3.008397 -1.842453 0.534259
C -3.322253 -1.573781 -0.960303
C 1.764560 0.332096 -0.533471
C -3.995578 0.392805 0.886879
C -4.024140 0.679218 -0.425275
C 0.870449 2.429479 0.478820
C 2.861285 0.133735 0.526593
C 4.772801 0.311682 -1.086234
C 5.106120 -0.675289 1.145081
C 3.827760 -1.909374 -0.560046
H -1.919805 1.397709 0.996957
H -1.067134 -0.903527 -0.978166
H 0.076190 0.674885 2.142432
H 0.205365 -0.822540 1.165963
H -0.071106 0.979302 -2.150211
H -0.981221 2.171264 -1.191474
H -2.775998 -0.677925 2.397966
H -3.101207 0.160660 -2.353972
H -3.844945 -2.411247 0.991916
H -2.119781 -2.482499 0.646343
H -2.759066 -2.252740 -1.619850
H -4.390942 -1.781962 -1.172847
H 2.163394 0.920955 -1.399229
H 1.440883 -0.656172 -0.952383
H -4.689269 0.745558 1.637487
H -4.750386 1.313461 -0.918367
H 1.579949 2.431247 1.324367
H 1.293279 3.059591 -0.327999
H -0.036883 2.965847 0.842355
H 2.473176 -0.483612 1.377539
H 3.148791 1.120146 0.975868
H 4.152309 0.390309 -1.997049
H 5.745489 -0.117921 -1.420340
H 5.003271 1.336974 -0.735222
H 6.058678 -1.153417 0.824764
H 5.388972 0.302228 1.583492
H 4.707365 -1.308457 1.962268
H 4.758283 -2.447116 -0.855872
H 3.200136 -1.879095 -1.468840
H 3.329648 -2.560800 0.184575


%chk=000203052-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000203052

2 1
N 0.532665 1.101815 0.039045
N 4.130858 -0.566471 -0.029329
C -1.635640 0.325118 0.774664
C -1.556506 0.127409 -0.757812
C -0.160102 0.189267 1.156412
C -0.569590 1.224987 -1.142173
C -2.858330 -0.507284 1.300945
C -3.014014 -0.083584 -1.304964
C -2.963042 -1.869953 0.526678
C -3.263212 -1.609285 -0.991617
C 1.794781 0.454384 -0.548128
C -4.037394 0.371409 0.862988
C -4.059898 0.656130 -0.470597
C 0.823963 2.492781 0.597563
C 2.896280 0.197567 0.509128
C 4.788342 0.182629 -1.195864
C 5.145181 -0.659752 1.126327
C 3.768136 -1.989377 -0.471561
H -1.908633 1.381389 0.979434
H -1.038212 -0.836844 -0.961876
H 0.119422 0.597983 2.140734
H 0.221124 -0.840388 1.040202
H -0.042635 1.094553 -2.101175
H -0.991668 2.240631 -1.079008
H -2.829242 -0.661446 2.391901
H -3.099538 0.123539 -2.383849
H -3.769724 -2.469355 0.978961
H -2.032060 -2.456733 0.656313
H -2.624192 -2.243349 -1.635806
H -4.311225 -1.852122 -1.228673
H 2.156888 1.136604 -1.335628
H 1.459278 -0.485291 -1.018177
H -4.775770 0.737549 1.582281
H -4.833173 1.265103 -0.948480
H 1.556530 2.437742 1.417200
H 1.199005 3.140292 -0.211147
H -0.113151 2.913745 0.991132
H 2.509295 -0.402188 1.350253
H 3.290361 1.146950 0.907952
H 4.130138 0.160696 -2.076658
H 5.734405 -0.321300 -1.444570
H 4.995496 1.220544 -0.892546
H 6.027571 -1.216705 0.777265
H 5.445071 0.354890 1.429958
H 4.684019 -1.190339 1.973378
H 4.694516 -2.515427 -0.747531
H 3.104135 -1.956051 -1.347268
H 3.282893 -2.517664 0.363516


