%chk=000190442.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190442

0 1
Cl -6.550674 0.634303 0.930752
O 5.342141 -2.391309 -0.374523
O -0.029988 3.212700 -1.341917
N -0.131313 -1.391605 0.059317
N -1.984385 2.324076 -0.633007
N 4.517347 1.325532 0.510149
C -0.718584 -0.157061 -0.206548
C -2.149442 -0.003233 0.087834
C 3.581060 -1.026602 0.409799
C 1.278672 -1.654885 -0.067400
C 4.605198 -0.077812 0.989839
C -2.748977 1.267921 -0.148631
C 2.215008 -0.793301 0.537480
C 3.984993 -2.185148 -0.297074
C -0.004947 0.898869 -0.722453
C 1.699232 -2.794231 -0.769717
C -2.961295 -1.044269 0.594145
C 3.064739 -3.068434 -0.875156
C -4.135144 1.467923 0.115562
C -0.568965 2.198363 -0.941246
C 3.466059 2.142634 1.197081
C -4.306941 -0.857120 0.854417
C -4.871505 0.410576 0.605196
C 2.969253 3.272645 0.300868
H 4.554422 -0.103912 2.101596
H 5.637297 -0.429895 0.728599
H -0.719588 -2.187503 0.298968
H 1.870626 0.085453 1.101711
H 1.040591 0.805585 -1.019993
H 0.976561 -3.460340 -1.238590
H -2.518844 -2.024979 0.787914
H -2.420289 3.237386 -0.791224
H 4.374895 1.338136 -0.505255
H 3.402963 -3.951592 -1.410686
H -4.595600 2.438022 -0.067947
H 2.597441 1.532321 1.541962
H 3.945576 2.562309 2.111234
H -4.925138 -1.664176 1.244223
H 3.799471 3.826007 -0.156179
H 2.320541 2.918109 -0.513401
H 2.376845 3.997573 0.872004
H 5.565888 -3.192434 -0.909907


%chk=000190442-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190442

0 1
Cl -7.186980 -0.447804 0.726312
O 5.253096 -1.867930 -0.063382
O -0.918746 3.625292 -0.226243
N -0.374618 -1.220668 -0.151327
N -2.768757 2.235855 0.048369
N 5.007253 1.094835 0.889307
C -1.128500 -0.049055 -0.052769
C -2.579671 -0.194204 0.158454
C 3.274930 -0.753958 0.741975
C 1.047073 -1.355772 -0.143872
C 4.178057 0.112734 1.624695
C -3.382243 0.995813 0.180597
C 1.876210 -0.581096 0.711614
C 3.846278 -1.744744 -0.104405
C -0.574775 1.224782 -0.167493
C 1.640377 -2.346837 -0.963680
C -3.232072 -1.442389 0.355205
C 3.037206 -2.547696 -0.936480
C -4.792365 0.911519 0.349459
C -1.367535 2.439928 -0.116364
C 4.273118 2.146344 0.151771
C -4.624147 -1.538964 0.527138
C -5.382137 -0.346217 0.511187
C 5.257597 3.137087 -0.493600
H 3.552667 0.663575 2.352733
H 4.865289 -0.537414 2.195785
H -0.887984 -2.074260 -0.371611
H 1.424776 0.155998 1.383971
H 0.489508 1.372460 -0.355025
H 1.017368 -2.950260 -1.634174
H -2.652898 -2.370756 0.410794
H -3.330728 3.091734 0.071775
H 5.706085 0.620583 0.300705
H 3.487701 -3.317241 -1.576645
H -5.403209 1.819499 0.357227
H 3.590920 1.739733 -0.635264
H 3.630359 2.682760 0.877792
H -5.109923 -2.505347 0.681237
H 5.909961 3.585619 0.275813
H 5.902248 2.629932 -1.237553
H 4.713184 3.945259 -1.014286
H 5.561226 -2.602126 -0.649943


