%chk=000201147.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201147

0 1
N -3.220818 -0.906777 -0.003016
C 0.502613 -0.206244 -0.685722
C -0.756423 -0.844114 -0.064424
C -2.044389 -0.263108 -0.674270
C 0.597184 1.267105 -0.334735
C 1.781211 -0.915531 -0.279296
C -3.525566 -2.243001 -0.616965
C -4.424075 -0.009768 -0.022809
C 0.414750 2.230919 -1.338325
C 2.867029 -0.905331 -1.171720
C 0.854298 1.682319 0.980671
C 1.916590 -1.566036 0.955155
C -4.367820 -3.081143 0.346438
C -4.236477 1.139299 0.969135
C 0.487535 3.591863 -1.027657
C 4.063416 -1.541638 -0.834853
C 0.926118 3.043347 1.286591
C 3.115747 -2.203851 1.287977
C 0.742199 4.001676 0.284302
C 4.190981 -2.195019 0.395569
H 0.404513 -0.305885 -1.801435
H -0.726326 -1.942027 -0.209054
H -0.777844 -0.689217 1.033334
H -2.048325 -0.390273 -1.776737
H -2.070129 0.835019 -0.485984
H -4.036998 -2.159809 -1.599994
H -2.561463 -2.767965 -0.804582
H -4.646988 0.389960 -1.035365
H -5.309262 -0.612184 0.283337
H 0.217640 1.923706 -2.362908
H 2.780561 -0.392806 -2.127998
H 1.004435 0.940963 1.764157
H 1.089836 -1.580031 1.663665
H -3.909971 -3.102607 1.345166
H -5.377652 -2.674028 0.469753
H -4.459758 -4.112933 -0.005929
H -3.968202 0.755467 1.962956
H -3.428994 1.816300 0.664763
H -5.152764 1.728448 1.068641
H 0.346424 4.334025 -1.811305
H 4.899588 -1.527643 -1.531853
H 1.127583 3.358345 2.309107
H 3.210212 -2.708288 2.248178
H 0.799300 5.060637 0.524735
H 5.122680 -2.691443 0.656306


%chk=000201147-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201147

0 1
N -3.272891 -0.879899 -0.016849
C 0.523521 -0.245156 -0.667396
C -0.757953 -0.846117 -0.021587
C -2.058959 -0.266011 -0.615142
C 0.621414 1.266001 -0.395609
C 1.815578 -0.968393 -0.249897
C -3.601016 -2.201225 -0.618335
C -4.437930 0.046046 0.005725
C 0.347275 2.207372 -1.419150
C 2.997775 -0.750768 -1.006881
C 0.958795 1.749858 0.895486
C 1.889453 -1.830841 0.872819
C -4.396743 -3.115477 0.333228
C -4.316256 1.134892 1.089322
C 0.405469 3.597472 -1.164162
C 4.213901 -1.375106 -0.659003
C 1.014746 3.136113 1.155911
C 3.107351 -2.457817 1.227639
C 0.737816 4.067302 0.126537
C 4.274335 -2.233727 0.464667
H 0.421483 -0.368760 -1.766657
H -0.743958 -1.945399 -0.157878
H -0.769287 -0.656049 1.068107
H -2.046044 -0.383052 -1.730760
H -2.082223 0.820198 -0.418326
H -4.157631 -2.081504 -1.583569
H -2.648859 -2.703577 -0.870423
H -4.598865 0.523715 -0.995066
H -5.342095 -0.554977 0.213236
H 0.087504 1.849579 -2.423797
H 2.960661 -0.077458 -1.872689
H 1.194123 1.036166 1.694237
H 0.996075 -2.024898 1.475392
H -3.828894 -3.272860 1.266681
H -5.376412 -2.680248 0.601780
H -4.585823 -4.097520 -0.139838
H -4.219959 0.668170 2.085070
H -3.432560 1.778556 0.929584
H -5.210322 1.786538 1.085859
H 0.192520 4.309795 -1.969637
H 5.112602 -1.193601 -1.259709
H 1.279942 3.491988 2.158217
H 3.142345 -3.121732 2.099279
H 0.785056 5.143486 0.327735
H 5.217140 -2.720377 0.738848


