%chk=000182458.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182458

0 1
Cl -3.976036 0.581258 2.480348
S -2.632072 1.662475 -0.335339
O -2.662407 1.909210 -1.750760
O -3.298106 2.561273 0.573000
O -0.151590 0.111461 -1.082592
N -0.964166 1.820524 0.198580
N 1.386436 1.473477 0.060025
N 3.731742 1.316872 0.147059
N 2.374740 -0.724324 0.119093
C -3.026135 0.015040 -0.016327
C -3.610244 -0.463890 1.158984
C -2.734605 -0.910376 -1.037086
C 0.078013 1.037575 -0.337757
C 2.524731 0.640604 0.090038
C -3.924679 -1.817403 1.325445
C -3.040348 -2.263595 -0.886356
C 4.858867 0.551887 0.210381
C 3.521967 -1.465507 0.171882
C -3.637135 -2.716617 0.295133
C 4.787541 -0.854216 0.216824
C 6.162582 1.270203 0.267982
C 3.362722 -2.946196 0.187573
H -0.753937 2.522721 0.922349
H -2.247069 -0.564503 -1.962983
H -4.385588 -2.166418 2.250208
H -2.803689 -2.965157 -1.686474
H 1.564549 2.474865 0.214474
H -3.876873 -3.774894 0.416707
H 5.690371 -1.453067 0.256249
H 6.034477 2.366556 0.263848
H 6.722635 1.011433 1.178625
H 6.795475 1.016160 -0.595697
H 3.861222 -3.409245 -0.677135
H 3.793091 -3.387096 1.098289
H 2.300515 -3.247391 0.147307


%chk=000182458-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182458

0 1
Cl -2.916498 0.480652 2.646640
S -2.545013 1.670982 -0.540927
O -2.529866 1.783224 -2.152932
O -3.268283 2.813537 0.349557
O -0.108038 -0.209924 -1.008901
N -0.831686 1.708954 0.113968
N 1.442531 1.263470 0.050421
N 3.749132 1.305546 0.248953
N 2.578164 -0.839868 0.113649
C -3.150952 -0.081406 -0.117327
C -3.333802 -0.531190 1.200755
C -3.440376 -0.888427 -1.230247
C 0.159645 0.814692 -0.340214
C 2.632061 0.517494 0.127798
C -3.834710 -1.832341 1.416800
C -3.945101 -2.187438 -1.011386
C 4.946037 0.649296 0.342484
C 3.783178 -1.490029 0.192784
C -4.142930 -2.652973 0.308820
C 4.997768 -0.767982 0.303720
C 6.189559 1.496081 0.480817
C 3.742763 -3.000037 0.163941
H -0.700905 2.424249 0.837326
H -3.255206 -0.495113 -2.235073
H -3.974634 -2.191698 2.440386
H -4.172559 -2.830996 -1.866249
H 1.593726 2.267124 0.185336
H -4.532275 -3.661195 0.483758
H 5.954960 -1.293118 0.367742
H 5.916938 2.562188 0.497742
H 6.736151 1.251365 1.410203
H 6.882913 1.319800 -0.362191
H 4.314473 -3.393707 -0.696801
H 4.190724 -3.429158 1.079260
H 2.699107 -3.338356 0.081284


