%chk=000212504.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212504

0 1
Cl 5.254649 -3.498334 -1.375333
O -0.414580 -0.539915 1.384993
O 2.359919 2.483590 -0.540702
N -2.794040 1.641498 -0.003927
N -2.405427 0.366182 0.544670
N 0.472464 2.427740 1.561836
C -1.742195 2.560743 0.406920
C -0.692310 1.876179 0.967026
C -1.045811 0.431559 1.026205
C -3.000146 -0.827025 -0.008143
C -4.169474 2.033249 0.429921
C -1.861935 4.004073 0.124723
C 1.666472 1.548332 1.538164
C -2.849712 -2.020475 0.724123
C -3.727130 -0.808650 -1.210568
C 2.363463 1.507851 0.180083
C 3.067747 0.246456 -0.186981
C -3.449556 -3.187341 0.250538
C -4.324803 -1.987847 -1.661433
C -4.192910 -3.175034 -0.935154
C 2.539707 -1.008265 0.152289
C 4.264822 0.335237 -0.917420
C 3.213238 -2.174854 -0.217545
C 4.952228 -0.823006 -1.284374
C 4.412198 -2.060952 -0.924987
H 0.701933 3.345009 1.145953
H -4.456142 2.945523 -0.118326
H -4.264911 2.217871 1.511956
H -4.886388 1.237226 0.159625
H -0.891132 4.435239 -0.174980
H -2.203483 4.560227 1.012965
H -2.563015 4.219586 -0.696538
H 2.386225 1.941953 2.297055
H 1.393815 0.524714 1.905139
H -2.255263 -2.032698 1.640601
H -3.809782 0.105667 -1.796999
H -3.335541 -4.115013 0.811362
H -4.891621 -1.980021 -2.592021
H -4.660799 -4.089103 -1.293923
H 1.587340 -1.081596 0.698161
H 4.651072 1.317702 -1.201865
H 2.807260 -3.153786 0.039191
H 5.884952 -0.763992 -1.844678


%chk=000212504-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212504

0 1
Cl 5.139477 -3.491433 -1.822029
O -0.477122 -0.588633 1.643568
O 2.658269 2.669971 -0.178811
N -2.738562 1.618953 -0.024275
N -2.366582 0.338675 0.501116
N 0.455290 2.357953 1.641756
C -1.701904 2.515791 0.372692
C -0.712493 1.832454 1.068785
C -1.104527 0.415384 1.162761
C -3.008822 -0.846333 0.031908
C -4.149872 2.008568 0.252346
C -1.778818 3.973019 0.024638
C 1.674559 1.536489 1.726551
C -2.995373 -2.012221 0.840402
C -3.644959 -0.864004 -1.237052
C 2.495902 1.560404 0.416923
C 3.119400 0.303072 -0.098906
C -3.622328 -3.185826 0.371853
C -4.282245 -2.041268 -1.682601
C -4.275455 -3.207637 -0.882884
C 2.636777 -0.988324 0.255187
C 4.214118 0.414480 -1.002109
C 3.246514 -2.145705 -0.275639
C 4.838201 -0.732386 -1.525744
C 4.341780 -1.999083 -1.148646
H 0.639494 3.343139 1.430453
H -4.338376 2.978339 -0.234278
H -4.345146 2.096525 1.340112
H -4.832366 1.260975 -0.180041
H -0.763404 4.407469 -0.015431
H -2.362506 4.563205 0.758359
H -2.233510 4.121399 -0.971003
H 2.331307 1.954177 2.515630
H 1.387943 0.521833 2.033779
H -2.483788 -1.992634 1.804934
H -3.604372 0.026538 -1.872470
H -3.605097 -4.086028 0.996083
H -4.770004 -2.050166 -2.663737
H -4.765875 -4.121458 -1.234946
H 1.758372 -1.103657 0.900224
H 4.560213 1.415075 -1.281047
H 2.870073 -3.140072 -0.020411
H 5.687213 -0.651520 -2.210396


