%chk=000213947.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213947

0 1
Cl 3.983199 -1.874102 -3.386458
O -1.816362 1.624121 -0.797925
O 1.634590 2.643183 2.844000
N 2.000241 1.945835 0.711534
N 1.461944 -0.657755 2.204937
C 1.377254 3.199126 0.183213
C 2.465882 0.986546 -0.249783
C 0.121148 2.903655 -0.642875
C 2.140299 -0.384851 -0.164783
C 1.987143 1.738829 2.113801
C 1.328463 -0.947925 0.950526
C 2.423901 0.370068 2.623313
C -1.016285 2.332293 0.201599
C 3.266005 1.453658 -1.318318
C 2.614567 -1.268340 -1.149340
C 0.281021 -1.936473 0.567919
C 3.735554 0.574022 -2.286523
C 3.402181 -0.783257 -2.189045
C -0.748125 -1.537418 -0.298090
C 0.311767 -3.240077 1.081818
C -3.022223 1.082739 -0.408718
C -1.746065 -2.449597 -0.648716
C -0.684807 -4.149417 0.715270
C -1.712540 -3.755672 -0.147723
C -3.515413 1.061503 0.900918
C -3.733806 0.513596 -1.485443
C -4.754762 0.452581 1.129873
C -4.963575 -0.082627 -1.224868
C -5.478377 -0.116071 0.079648
H 2.122309 3.748631 -0.433555
H 1.132278 3.862198 1.051811
H -0.213546 3.828709 -1.154722
H 0.346285 2.189120 -1.467524
H 3.474453 0.144511 2.332152
H 2.403051 0.388513 3.745342
H -0.676852 1.597008 0.952724
H -1.634108 3.111531 0.676383
H 3.526016 2.511645 -1.379253
H 2.357974 -2.331269 -1.096970
H 4.356726 0.931878 -3.109812
H -0.779622 -0.516005 -0.688016
H 1.100022 -3.535366 1.773590
H -2.556648 -2.134772 -1.306769
H -0.663774 -5.163718 1.110517
H -2.491259 -4.464230 -0.425267
H -2.961253 1.489575 1.729243
H -3.316609 0.557256 -2.487480
H -5.154249 0.422911 2.144017
H -5.532709 -0.525665 -2.042046
H -6.439801 -0.585033 0.270575


%chk=000213947-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000213947

0 1
Cl 3.703997 -1.737380 -3.727468
O -2.082157 2.260634 -0.939968
O 1.937471 2.537961 3.063794
N 1.937794 1.901631 0.809422
N 1.783219 -0.745450 2.274077
C 1.329971 3.214959 0.437794
C 2.365103 1.005741 -0.225567
C 0.128689 3.085540 -0.519270
C 2.119379 -0.405335 -0.161459
C 2.205415 1.678509 2.180948
C 1.474990 -1.051182 1.027079
C 2.803168 0.302932 2.506151
C -0.986224 2.196973 0.040691
C 2.992482 1.547223 -1.381056
C 2.535925 -1.226695 -1.246182
C 0.446592 -2.117070 0.815625
C 3.400106 0.727844 -2.448285
C 3.169022 -0.660351 -2.360300
C -0.372441 -2.140452 -0.346204
C 0.238523 -3.097284 1.824348
C -3.222089 1.468573 -0.709071
C -1.375908 -3.122339 -0.495338
C -0.755721 -4.083071 1.668283
C -1.567382 -4.099795 0.507394
C -3.383910 0.601320 0.399821
C -4.242708 1.582730 -1.686148
C -4.576912 -0.150191 0.518179
C -5.424822 0.828571 -1.551941
C -5.600325 -0.043905 -0.448854
H 2.095113 3.881017 -0.005555
H 1.027582 3.672922 1.395376
H -0.277459 4.099591 -0.692952
H 0.438790 2.692156 -1.504558
H 3.719051 0.147395 1.894735
H 3.070233 0.307219 3.572420
H -0.644779 1.148575 0.156288
H -1.337068 2.564073 1.027384
H 3.180424 2.623212 -1.438862
H 2.358606 -2.304782 -1.200369
H 3.893315 1.157320 -3.324749
H -0.245090 -1.379817 -1.124487
H 0.862437 -3.057438 2.722433
H -2.012490 -3.116346 -1.386459
H -0.901117 -4.838321 2.448623
H -2.342611 -4.864969 0.388437
H -2.605550 0.500003 1.161765
H -4.088515 2.261737 -2.530613
H -4.698274 -0.822308 1.375103
H -6.211555 0.921943 -2.309089
H -6.520787 -0.628220 -0.346661


