%chk=000200917.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200917

1 1
N -2.590519 0.935460 0.004707
N 0.394540 0.388183 -0.437681
C -2.110693 -0.081869 1.053518
C -3.791561 1.644219 0.660641
C -3.323791 -0.418066 1.925813
C -4.409198 0.628699 1.628185
C -1.519255 1.969417 -0.334834
C -3.054936 0.211329 -1.237439
C -0.331760 1.452563 -1.177813
C 1.589555 0.854117 0.250506
C 0.450927 -0.927568 -1.038440
C 2.862847 0.343281 -0.049576
C 0.746406 -2.005874 -0.178930
C 1.427642 1.817921 1.262126
C 0.142920 -1.167282 -2.387495
C 3.968648 0.787799 0.679013
C 0.722169 -3.308474 -0.676213
C 2.546298 2.255341 1.976177
C 0.118938 -2.480863 -2.867522
C 3.814834 1.742089 1.690150
C 0.400556 -3.551882 -2.017138
H -1.277619 0.356579 1.650202
H -1.673413 -0.980032 0.560263
H -4.513031 1.995122 -0.106058
H -3.443792 2.546806 1.211436
H -3.046385 -0.415158 2.999671
H -3.695010 -1.442847 1.726249
H -5.313782 0.154743 1.198923
H -4.754865 1.126876 2.556773
H -1.996257 2.816633 -0.881186
H -1.114131 2.385176 0.626530
H -2.251909 -0.430209 -1.657478
H -3.907569 -0.457988 -1.011412
H -3.375348 0.910738 -2.028219
H -0.678211 1.106846 -2.179053
H 0.332517 2.330277 -1.387536
H 2.997691 -0.395117 -0.840941
H 1.016724 -1.822102 0.861259
H 0.445413 2.220914 1.496280
H -0.037165 -0.344223 -3.077262
H 4.960212 0.389943 0.451728
H 0.960635 -4.144571 -0.014795
H 2.428076 3.001529 2.763496
H -0.109564 -2.665826 -3.919131
H 4.683642 2.086175 2.252686
H 0.385775 -4.573620 -2.398082


%chk=000200917-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200917

1 1
N -2.592961 0.881790 0.088488
N 0.586612 0.533098 -0.597497
C -2.137011 -0.161867 1.137158
C -3.803866 1.545869 0.793790
C -3.443905 -0.714847 1.746031
C -4.523244 0.402483 1.541435
C -1.529306 1.956908 -0.207995
C -3.060420 0.189161 -1.186622
C -0.332551 1.556637 -1.112662
C 1.728796 0.948447 0.176042
C 0.472193 -0.820711 -1.082566
C 2.920234 0.169039 0.186594
C 0.624686 -1.911500 -0.179263
C 1.715823 2.170762 0.905887
C 0.192317 -1.100863 -2.448032
C 4.045276 0.590313 0.922716
C 0.491888 -3.241189 -0.631742
C 2.854259 2.588829 1.630749
C 0.042958 -2.435602 -2.889926
C 4.023922 1.800231 1.654898
C 0.188161 -3.513136 -1.987083
H -1.532447 0.386732 1.878852
H -1.501506 -0.913985 0.648337
H -4.417179 2.061147 0.037535
H -3.387563 2.294196 1.489253
H -3.292720 -0.946234 2.812332
H -3.748109 -1.652677 1.253429
H -5.383021 0.022723 0.966097
H -4.916599 0.771964 2.501653
H -2.068845 2.785372 -0.704847
H -1.180665 2.306560 0.777444
H -2.242689 -0.425423 -1.591012
H -3.920753 -0.452913 -0.949013
H -3.361552 0.954636 -1.919231
H -0.714324 1.256245 -2.102013
H 0.221622 2.501497 -1.278746
H 2.978889 -0.751837 -0.400159
H 0.875006 -1.711657 0.868632
H 0.834627 2.820146 0.917811
H 0.143521 -0.289673 -3.183683
H 4.951719 -0.024261 0.906694
H 0.625652 -4.065696 0.076761
H 2.820311 3.536359 2.179494
H -0.158137 -2.631155 -3.948686
H 4.902503 2.124624 2.220480
H 0.085604 -4.545342 -2.335713


