%chk=000203317.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203317

0 1
S 1.251483 0.244646 -1.165756
N -0.841561 1.835431 -0.942897
N -1.380564 -0.437384 -0.517270
C -2.210805 2.329534 -0.603082
C -2.442818 2.417796 0.920871
C -2.414795 3.698679 -1.285109
C -1.113010 -1.888447 -0.559055
C -1.645511 3.549205 1.577764
C -1.635321 4.832158 -0.606996
C -1.926065 4.896332 0.898186
C -2.370343 -2.587708 -1.128608
C -0.775260 -2.424011 0.853427
C -3.556254 -2.546384 -0.157042
C -1.977466 -2.372300 1.803057
C -3.179346 -3.123865 1.213915
C -0.527494 0.483437 -0.775504
C 1.924370 -0.184287 0.478292
C 3.223935 -0.860310 0.195515
C 4.409423 -0.110869 0.124722
C 3.268767 -2.250370 -0.002016
C 5.625184 -0.748047 -0.136604
C 4.487776 -2.880655 -0.262631
C 5.667742 -2.132461 -0.328924
H -2.945918 1.593905 -1.032457
H -2.192093 1.445934 1.390097
H -3.524217 2.566213 1.105196
H -2.127981 3.630454 -2.353177
H -3.497000 3.933378 -1.274902
H -0.247539 -2.125395 -1.239479
H -1.900541 3.609923 2.652795
H -0.563250 3.324040 1.536486
H -0.549592 4.699742 -0.776003
H -1.896325 5.797184 -1.081948
H -1.316544 5.690925 1.366927
H -2.982439 5.184075 1.062499
H -2.112566 -3.636349 -1.367395
H -2.657542 -2.108751 -2.084668
H 0.071483 -1.845291 1.284200
H -0.419810 -3.467573 0.756860
H -3.887557 -1.494288 -0.037649
H -4.412316 -3.099535 -0.583032
H -1.703431 -2.799057 2.784572
H -2.256873 -1.314692 1.984019
H -2.944386 -4.200551 1.120156
H -4.041511 -3.055480 1.902342
H -0.093157 2.506710 -0.756092
H 2.042735 0.731511 1.086316
H 1.213629 -0.845792 1.030091
H 4.382950 0.968212 0.265602
H 2.352802 -2.837244 0.038494
H 6.541748 -0.162834 -0.192627
H 4.518191 -3.958097 -0.417087
H 6.615680 -2.626098 -0.532392


%chk=000203317-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000203317

0 1
S 1.112234 -0.226949 -1.381246
N -0.852969 1.578161 -0.810613
N -1.494035 -0.595596 -0.165298
C -2.154962 2.213372 -0.500930
C -2.348216 2.428738 1.026566
C -2.266449 3.556713 -1.263619
C -1.345172 -2.060646 -0.139525
C -1.392754 3.505989 1.589209
C -1.316931 4.643499 -0.697667
C -1.535251 4.843490 0.821795
C -2.495571 -2.710065 -0.960464
C -1.393552 -2.569929 1.328788
C -3.879843 -2.469937 -0.315348
C -2.776136 -2.331137 1.980460
C -3.909078 -2.978016 1.146683
C -0.626216 0.222347 -0.666305
C 1.988568 -0.731599 0.262819
C 3.462643 -0.915991 0.000821
C 4.365094 0.170634 0.139710
C 3.970745 -2.177710 -0.404381
C 5.743858 -0.000296 -0.114006
C 5.348907 -2.351280 -0.660918
C 6.240178 -1.262640 -0.515842
H -2.936129 1.511612 -0.852768
H -2.207743 1.460593 1.540591
H -3.399354 2.740842 1.198084
H -2.079601 3.392909 -2.342632
H -3.310595 3.914466 -1.166482
H -0.378058 -2.361791 -0.603741
H -1.590694 3.659925 2.667462
H -0.346982 3.144679 1.506366
H -0.256905 4.364921 -0.879625
H -1.479350 5.595397 -1.238871
H -0.820358 5.592145 1.214970
H -2.553463 5.252556 0.989728
H -2.298579 -3.800858 -1.019797
H -2.472820 -2.314924 -1.993728
H -0.599297 -2.074001 1.920783
H -1.171067 -3.657495 1.322982
H -4.092502 -1.383242 -0.327174
H -4.667299 -2.969319 -0.913071
H -2.780654 -2.731786 3.013119
H -2.952878 -1.239996 2.046896
H -3.785406 -4.082039 1.153877
H -4.892691 -2.762449 1.608082
H -0.076911 2.147138 -1.148423
H 1.791332 0.077500 0.983516
H 1.511717 -1.660875 0.611600
H 3.982344 1.151866 0.445664
H 3.281230 -3.022467 -0.521744
H 6.429515 0.846779 0.000975
H 5.727114 -3.331607 -0.971871
H 7.309686 -1.396330 -0.713456


