%chk=000240684.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240684

0 1
Cl 0.057054 -1.642233 -2.094652
N -1.608579 -0.312790 -0.512107
N 0.682207 0.268924 -0.271047
C 3.011674 0.328339 0.445393
C 4.387909 0.450662 0.120046
C 2.054174 0.323075 -0.637030
C -2.496110 -1.440150 -0.733033
C -2.115456 0.830758 0.222680
C 2.627695 0.216874 1.818138
C 4.787763 0.577382 -1.248727
C 2.466290 0.452599 -1.950911
C -0.244924 -0.423909 -0.829001
C 5.355600 0.446512 1.174880
C 3.849747 0.582269 -2.249683
C 3.577179 0.217650 2.810160
C -3.729400 -1.205050 -1.363687
C -3.026616 0.622153 1.273022
C -2.129352 -2.729777 -0.313995
C -1.725989 2.129538 -0.146507
C 4.959024 0.331227 2.483877
C -4.596429 -2.278900 -1.575901
C -3.551909 1.727113 1.945887
C -3.008140 -3.790700 -0.543982
C -2.257999 3.219343 0.545324
C -4.239111 -3.569244 -1.170594
C -3.171691 3.024021 1.586459
H 1.565288 0.141149 2.060234
H 5.848115 0.670804 -1.475558
H 1.751244 0.462494 -2.771461
H 6.408866 0.537231 0.915605
H 4.146375 0.681928 -3.293742
H -4.002140 -0.200144 -1.684660
H -3.318904 -0.385833 1.563768
H -1.173119 -2.906096 0.177455
H -1.006955 2.288161 -0.949536
H 3.290012 0.134588 3.856597
H 5.690177 0.326910 3.290964
H -5.554993 -2.107933 -2.065738
H -4.259240 1.573418 2.760587
H -2.730015 -4.796982 -0.230391
H -1.955917 4.229587 0.268709
H -4.918289 -4.401902 -1.344958
H -3.582218 3.879735 2.118415


%chk=000240684-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240684

0 1
Cl -0.081225 -1.733232 -2.486562
N -1.599120 -0.464484 -0.527703
N 0.731021 -0.058342 -0.327252
C 3.001315 0.335903 0.438848
C 4.390548 0.616856 0.145183
C 2.068606 0.184650 -0.661519
C -2.568032 -1.517994 -0.763876
C -2.019530 0.706172 0.222192
C 2.588829 0.213288 1.804350
C 4.809714 0.758615 -1.218864
C 2.516528 0.340268 -1.987848
C -0.265312 -0.605835 -0.894460
C 5.315656 0.751440 1.233841
C 3.885271 0.629102 -2.258536
C 3.513027 0.352587 2.843517
C -3.793110 -1.207564 -1.399569
C -2.960679 0.560227 1.272011
C -2.300762 -2.839022 -0.333969
C -1.515331 1.990801 -0.100830
C 4.889335 0.620187 2.557033
C -4.749348 -2.224143 -1.607810
C -3.393918 1.696181 1.989665
C -3.256143 -3.853727 -0.557460
C -1.949165 3.117282 0.627817
C -4.483504 -3.550349 -1.191605
C -2.890959 2.978976 1.674764
H 1.532045 0.018021 2.010033
H 5.863058 0.973974 -1.433022
H 1.808543 0.234933 -2.814112
H 6.367961 0.960875 1.006899
H 4.206959 0.745109 -3.299249
H -3.985442 -0.181848 -1.730269
H -3.346917 -0.431971 1.524251
H -1.350930 -3.065769 0.161099
H -0.791537 2.108114 -0.912363
H 3.185254 0.260651 3.884937
H 5.604587 0.725201 3.380393
H -5.695311 -1.983298 -2.104844
H -4.119580 1.573604 2.801245
H -3.044263 -4.877865 -0.231797
H -1.554383 4.106444 0.371605
H -5.224751 -4.338884 -1.360822
H -3.226106 3.857668 2.235957


