%chk=000238512.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238512

0 1
Cl 4.835086 0.155783 2.066365
O 0.021857 -1.195594 -2.357423
N -2.160435 1.290558 0.543362
N -3.836593 -0.964331 0.247191
C -0.997517 0.786747 -1.548885
C 1.253878 -0.123848 -0.645548
C 0.100146 -0.272217 -1.575746
C -2.037832 0.457402 -0.524795
C 1.267579 0.804719 0.406321
C 2.359729 -0.972353 -0.844234
C 2.376276 0.893914 1.251718
C 3.474720 -0.890836 -0.009819
C -2.879854 -0.679569 -0.664805
C 3.463211 0.045358 1.027765
C -3.121892 0.999892 1.457607
C -3.962049 -0.124041 1.307605
H -1.469896 0.838945 -2.558387
H -0.572039 1.801654 -1.379899
H 0.410485 1.463462 0.581600
H 2.333470 -1.701452 -1.661970
H 2.391452 1.612119 2.071874
H 4.334115 -1.544212 -0.161620
H -2.775111 -1.367009 -1.515785
H -3.209542 1.680483 2.311778
H -4.743545 -0.365075 2.036428


%chk=000238512-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238512

0 1
Cl 4.855795 0.213470 2.218477
O 0.106505 -1.206900 -2.494835
N -2.032252 1.185818 0.594319
N -3.960695 -0.881292 0.210451
C -1.028850 0.758882 -1.630286
C 1.260518 -0.117818 -0.678727
C 0.131675 -0.264063 -1.651269
C -2.059857 0.445527 -0.558939
C 1.257458 0.855106 0.358697
C 2.373879 -0.995244 -0.807645
C 2.349205 0.954392 1.246743
C 3.471300 -0.901420 0.067131
C -3.026946 -0.582499 -0.738470
C 3.440915 0.078762 1.082920
C -2.969660 0.892397 1.542623
C -3.925339 -0.133329 1.354841
H -1.500446 0.706336 -2.625981
H -0.651417 1.780899 -1.464170
H 0.394065 1.513960 0.500227
H 2.356728 -1.744050 -1.606137
H 2.351111 1.695904 2.050451
H 4.331629 -1.569168 -0.032225
H -3.051053 -1.177077 -1.657573
H -2.946719 1.489589 2.459906
H -4.671850 -0.367681 2.120169


