%chk=000259428.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259428

0 1
Cl 5.641642 0.585879 1.979139
N -1.784369 1.522027 -0.800054
N -0.607007 1.250114 -0.206538
C -3.275151 1.567016 1.837492
C -4.258857 0.831932 0.918277
C -2.673200 2.844087 1.239930
C -3.550773 -0.165328 -0.006469
C -2.373591 2.796506 -0.266238
C -2.801130 0.491955 -1.172199
C 0.095502 0.151561 -0.264885
C 1.471209 0.258125 0.298859
C -0.243443 -1.173379 -0.846735
C 1.993933 -0.773442 1.097311
C 2.255728 1.393987 0.027396
C -0.813926 -2.180736 -0.055328
C 0.045011 -1.422732 -2.197740
C 3.285254 -0.676516 1.620692
C 3.547856 1.501621 0.545774
C -1.104787 -3.427065 -0.617446
C -0.248069 -2.670724 -2.752831
C 4.041804 0.461452 1.335090
C -0.824360 -3.673181 -1.965085
H -3.782387 1.825565 2.787927
H -2.451344 0.879559 2.120797
H -4.995750 0.283975 1.538656
H -4.850361 1.555706 0.327250
H -3.349128 3.700808 1.430020
H -1.732223 3.071869 1.784489
H -2.848719 -0.785153 0.587131
H -4.292341 -0.876061 -0.422898
H -3.300164 2.992933 -0.848345
H -1.655561 3.612998 -0.517424
H -2.303641 -0.290155 -1.789192
H -3.525364 0.994930 -1.852844
H 1.394513 -1.658039 1.311616
H 1.847046 2.199001 -0.586096
H -1.027807 -1.990637 0.995549
H 0.500581 -0.642469 -2.806681
H 3.694103 -1.473827 2.239870
H 4.157898 2.379879 0.338722
H -1.547384 -4.209003 -0.002582
H -0.022803 -2.864443 -3.800545
H -1.049642 -4.644994 -2.399930


%chk=000259428-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259428

0 1
Cl 5.591836 0.612037 2.458374
N -1.840553 1.345254 -0.902431
N -0.587613 1.180891 -0.381526
C -3.112730 2.017198 1.685170
C -4.186412 1.075360 1.072565
C -2.580952 3.144494 0.760065
C -3.588898 -0.103268 0.262098
C -2.341913 2.729196 -0.718498
C -2.892569 0.297206 -1.062400
C 0.119193 0.053591 -0.303410
C 1.447127 0.185564 0.362938
C -0.243619 -1.291311 -0.877127
C 2.409879 -0.863145 0.308244
C 1.794789 1.371440 1.077299
C -0.529879 -2.398513 -0.035163
C -0.251339 -1.486879 -2.284959
C 3.667628 -0.740659 0.939292
C 3.046309 1.509962 1.705984
C -0.843863 -3.662127 -0.584853
C -0.558559 -2.751170 -2.836496
C 3.969098 0.445663 1.630912
C -0.860958 -3.842434 -1.988060
H -3.520136 2.492723 2.598815
H -2.258611 1.394680 2.018444
H -4.791574 0.647206 1.895854
H -4.892605 1.654469 0.441228
H -3.289623 3.997362 0.755651
H -1.631466 3.520539 1.185094
H -2.867727 -0.649155 0.902391
H -4.390143 -0.825823 0.004456
H -3.285186 2.797294 -1.289216
H -1.620677 3.424632 -1.183102
H -2.463257 -0.593129 -1.544117
H -3.640511 0.717223 -1.761089
H 2.184777 -1.783617 -0.239046
H 1.062316 2.182084 1.122718
H -0.502922 -2.264588 1.052627
H -0.011463 -0.643567 -2.942762
H 4.398493 -1.552981 0.886716
H 3.300395 2.424077 2.251078
H -1.069381 -4.504184 0.079310
H -0.557779 -2.885160 -3.924151
H -1.100122 -4.822834 -2.415012


