%chk=000268686.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268686

0 1
Cl -2.679652 1.735646 -2.061258
S 0.688785 -1.226585 0.158184
O 1.908878 2.475385 0.076227
N 2.783810 0.333471 0.102732
N 3.439412 -1.887704 0.132322
C 4.271157 0.439901 0.072876
C 4.695598 -1.066879 0.095670
C 2.440208 -1.069977 0.132544
C 1.742745 1.278342 0.098322
C 0.444515 0.527982 0.134469
C -0.757786 1.106163 0.129532
C -2.032718 0.377582 0.179649
C -3.012936 0.612307 -0.799072
C -2.320000 -0.537175 1.205948
C -4.243977 -0.044694 -0.783022
C -3.552127 -1.195805 1.236513
C -4.509874 -0.954043 0.245329
H 4.638963 1.002061 0.953224
H 4.606188 0.965416 -0.842620
H 5.278414 -1.350006 -0.803617
H 5.308321 -1.314749 0.985272
H -0.843177 2.206230 0.076370
H -1.581892 -0.726026 1.988167
H -4.984053 0.150354 -1.559890
H -3.766344 -1.903596 2.037657
H -5.467561 -1.474603 0.272872


%chk=000268686-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268686

0 1
Cl -3.010607 2.502632 -1.389071
S 0.930481 -1.433224 0.756371
O 1.790803 2.169845 -0.781717
N 2.877803 0.246958 0.046466
N 3.757641 -1.726441 0.890859
C 4.328037 0.515547 -0.060287
C 4.922596 -0.836271 0.511337
C 2.693104 -1.040367 0.594982
C 1.759453 1.009590 -0.285972
C 0.514059 0.222814 0.040105
C -0.721866 0.748733 -0.218090
C -2.064700 0.213858 -0.006847
C -3.209367 0.922920 -0.488525
C -2.335396 -1.009452 0.684154
C -4.525044 0.462247 -0.312986
C -3.645696 -1.486525 0.870963
C -4.747129 -0.753847 0.371358
H 4.601891 1.398235 0.542193
H 4.609395 0.703966 -1.110136
H 5.538916 -1.363943 -0.236616
H 5.543990 -0.667266 1.407368
H -0.665532 1.748556 -0.672763
H -1.506561 -1.589960 1.098076
H -5.362680 1.045128 -0.705696
H -3.808752 -2.426503 1.407753
H -5.769943 -1.118233 0.511121