%chk=000199012.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000199012

0 1
Cl -3.936852 -0.935805 -2.114451
O 3.054989 2.446775 -0.086778
N 0.989312 -1.032196 -0.053099
C 2.487252 -1.079769 -0.023080
C 0.401398 0.189195 0.582371
C 3.025037 0.162256 -0.776858
C 0.893749 1.441651 -0.168623
C 2.400450 1.453242 -0.306013
C 3.053368 -1.104287 1.411630
C 2.909066 -2.360336 -0.765577
C -1.115030 0.110520 0.509437
C -1.752948 -0.338019 -0.655779
C -1.880706 0.509866 1.615394
C -3.147015 -0.379689 -0.682056
C -3.277357 0.461878 1.561399
C -3.927240 0.013656 0.407576
H 0.715143 0.281688 1.659520
H 2.817222 0.052621 -1.863356
H 4.128020 0.216749 -0.688314
H 0.583224 -1.878409 0.360925
H 0.541392 2.360584 0.341041
H 0.447490 1.476490 -1.186846
H 2.860912 -0.169796 1.949265
H 2.632292 -1.922178 2.003669
H 4.140855 -1.241842 1.406098
H 2.642012 -3.264854 -0.209235
H 2.422152 -2.430007 -1.747523
H 3.991112 -2.387663 -0.930631
H -1.163015 -0.653710 -1.520329
H -1.391465 0.863328 2.521944
H -3.864834 0.775905 2.424158
H -5.014387 -0.027542 0.357921


%chk=000199012-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000199012

0 1
Cl -3.973732 -1.154059 -2.145440
O 3.133524 2.439467 0.134916
N 1.014160 -1.008285 -0.029136
C 2.506044 -1.080544 -0.039814
C 0.399815 0.174340 0.613360
C 3.026655 0.181004 -0.805315
C 0.908003 1.459381 -0.121844
C 2.429370 1.462143 -0.235467
C 3.127660 -1.118193 1.388665
C 2.900289 -2.356877 -0.813880
C -1.124251 0.094054 0.546876
C -1.758559 -0.438520 -0.605013
C -1.918046 0.590564 1.609645
C -3.162115 -0.458979 -0.660964
C -3.328181 0.564741 1.524929
C -3.970034 0.035556 0.381544
H 0.685473 0.280333 1.688070
H 2.712173 0.086824 -1.863284
H 4.127651 0.237518 -0.762083
H 0.592893 -1.887606 0.300687
H 0.569677 2.369116 0.401801
H 0.475280 1.454265 -1.141269
H 2.910191 -0.197874 1.960817
H 2.733521 -1.981185 1.957461
H 4.227031 -1.217480 1.334694
H 2.566141 -3.265293 -0.276210
H 2.435378 -2.357204 -1.815405
H 3.996630 -2.421060 -0.931216
H -1.148166 -0.830307 -1.423832
H -1.432306 0.996986 2.504702
H -3.935927 0.951312 2.349969
H -5.060641 0.006164 0.305835


