%chk=000186716.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186716

0 1
Cl -5.690541 0.501198 0.008555
O 0.585484 -2.242790 -0.117693
O 0.875115 2.422032 0.100726
N 2.372449 -0.702386 -0.213663
N 2.458970 0.672562 0.189213
N 0.235278 0.120493 -0.006836
C 3.498954 -1.529538 0.316446
C 3.676588 1.354033 -0.346750
C 4.811979 -0.912183 -0.196342
C 4.905549 0.578643 0.159701
C 0.995999 -1.112318 -0.067064
C 1.143324 1.249868 0.048935
C -1.203401 0.211170 -0.003461
C -1.972297 -0.941858 -0.239214
C -1.822133 1.451954 0.235673
C -3.370211 -0.865137 -0.236631
C -3.214702 1.531869 0.236113
C -3.971489 0.383635 0.002772
C -4.211080 -2.069416 -0.481085
H 3.355030 -2.563881 -0.072740
H 3.491927 -1.579423 1.427524
H 3.663775 2.398124 0.042923
H 3.670279 1.404894 -1.457781
H 4.881224 -1.041835 -1.295929
H 5.669644 -1.463842 0.234073
H 4.995773 0.698419 1.258897
H 5.822794 1.019989 -0.275110
H -1.491416 -1.908914 -0.421673
H -1.231366 2.355477 0.416427
H -3.706770 2.489055 0.418941
H -3.619258 -2.978691 -0.650955
H -4.878795 -2.268534 0.372707
H -4.859276 -1.930567 -1.361300


%chk=000186716-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186716

0 1
Cl -5.797407 0.539607 0.040273
O 0.591319 -2.290176 0.016891
O 0.903934 2.482297 -0.022528
N 2.351030 -0.718992 -0.097208
N 2.444537 0.694917 0.073442
N 0.264572 0.127700 -0.000377
C 3.494043 -1.539896 0.339005
C 3.681068 1.359739 -0.372466
C 4.797849 -0.922949 -0.212146
C 4.897576 0.576744 0.167009
C 1.008871 -1.103478 -0.028479
C 1.163644 1.251557 0.018374
C -1.173883 0.224588 0.008659
C -1.964840 -0.923903 -0.255333
C -1.802668 1.467367 0.280968
C -3.379785 -0.863835 -0.250955
C -3.209680 1.543030 0.283562
C -3.971606 0.391517 0.022103
C -4.203809 -2.103594 -0.529184
H 3.317593 -2.559316 -0.039891
H 3.527420 -1.581314 1.448131
H 3.643266 2.392696 0.009013
H 3.709884 1.399557 -1.481755
H 4.819637 -1.032512 -1.313449
H 5.658376 -1.482205 0.196077
H 4.943941 0.682141 1.267960
H 5.820097 1.019166 -0.249249
H -1.477880 -1.882209 -0.445767
H -1.205823 2.361283 0.465970
H -3.704816 2.496202 0.489009
H -3.553688 -2.973638 -0.716395
H -4.867320 -2.340763 0.322650
H -4.858051 -1.959225 -1.408515


