%chk=000180180.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180180

0 1
Cl 2.485967 -3.929704 -2.848086
O 0.326806 1.844979 0.541959
O 1.745926 3.506391 -0.116646
O -3.614334 -1.381359 -0.404274
N 2.556168 1.596627 0.995619
N -1.888751 3.516495 2.406756
C 4.016816 1.833242 0.691306
C 2.167372 0.240394 1.470016
C 4.289626 1.712417 -0.808555
C 4.422270 3.202526 1.235562
C 2.256139 -0.806247 0.384370
C 1.608525 2.418946 0.405041
C -0.799487 2.693718 0.166964
C 3.269548 -1.774685 0.416207
C 1.314528 -0.810595 -0.657163
C -1.724725 1.797972 -0.630214
C 3.344934 -2.748576 -0.583872
C 1.380329 -1.775117 -1.663700
C -2.173563 0.591332 -0.077664
C 2.397666 -2.732058 -1.609693
C -2.118456 2.191411 -1.913519
C -3.030814 -0.203215 -0.844937
C -2.983607 1.375162 -2.657171
C -3.447508 0.170501 -2.136678
C -1.413550 3.152892 1.420647
C -3.035255 -2.085614 0.663425
C -1.677424 -2.418640 0.685780
C -3.944807 -2.528213 1.631787
C -1.221093 -3.231674 1.726949
C -3.461709 -3.342840 2.658141
C -2.106103 -3.690735 2.709106
H 4.582177 1.032010 1.238911
H 1.122512 0.284496 1.874826
H 2.819111 -0.013883 2.337964
H 3.765818 2.493185 -1.380319
H 5.357676 1.822668 -1.026913
H 3.968217 0.742509 -1.207568
H 4.205997 3.298044 2.306054
H 3.879618 4.017916 0.728139
H 5.491963 3.384970 1.089474
H -0.419202 3.574527 -0.426676
H 4.005036 -1.775945 1.220063
H 0.526580 -0.047872 -0.678103
H 4.128747 -3.505639 -0.564536
H 0.654296 -1.781782 -2.477416
H -1.867825 0.294327 0.925325
H -1.762566 3.126815 -2.342134
H -3.293524 1.688036 -3.655584
H -4.121191 -0.477469 -2.695083
H -1.001758 -2.068981 -0.092089
H -4.993088 -2.243655 1.569024
H -0.168550 -3.512753 1.767142
H -4.146060 -3.705842 3.425235
H -1.740316 -4.323814 3.515302


%chk=000180180-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180180

0 1
Cl 2.802835 -4.734637 -1.845446
O 0.500432 1.854087 1.188187
O 1.414046 3.548897 -0.177189
O -3.799481 -1.191243 -0.619680
N 2.727641 1.742190 0.575067
N -1.983427 2.536010 3.408697
C 3.967368 2.182870 -0.153972
C 2.816102 0.512117 1.403254
C 3.756400 2.232282 -1.683582
C 4.506954 3.515190 0.413777
C 2.826951 -0.776392 0.582455
C 1.574935 2.473998 0.464390
C -0.825512 2.538025 1.008091
C 3.878453 -1.713456 0.720921
C 1.765990 -1.066735 -0.314801
C -1.626958 1.824120 -0.072247
C 3.880983 -2.923385 -0.012493
C 1.750633 -2.267526 -1.055969
C -2.335372 0.634169 0.220055
C 2.813148 -3.179886 -0.891306
C -1.608068 2.344544 -1.389300
C -3.012405 -0.036719 -0.822099
C -2.307413 1.669087 -2.414975
C -3.009146 0.477298 -2.139799
C -1.461599 2.527264 2.336963
C -3.507249 -2.112054 0.425959
C -2.188547 -2.522125 0.729887
C -4.620828 -2.685885 1.074569
C -1.992581 -3.515887 1.714606
C -4.409254 -3.682022 2.053273
C -3.097031 -4.097740 2.380111
H 4.703757 1.384477 0.060076
H 1.959679 0.511031 2.095975
H 3.738308 0.575195 2.011585
H 3.026775 3.013564 -1.951479
H 4.716111 2.464132 -2.179912
H 3.396458 1.259534 -2.062492
H 4.672285 3.446001 1.504238
H 3.797059 4.335014 0.215446
H 5.470719 3.762600 -0.066890
H -0.615777 3.581016 0.699080
H 4.707444 -1.507097 1.408861
H 0.945732 -0.349688 -0.433895
H 4.695670 -3.645010 0.096064
H 0.933440 -2.490027 -1.748756
H -2.368638 0.245909 1.243552
H -1.041851 3.256582 -1.605048
H -2.303380 2.069982 -3.433800
H -3.558660 -0.060514 -2.917977
H -1.331938 -2.085647 0.206534
H -5.625961 -2.348744 0.804778
H -0.973316 -3.839525 1.952104
H -5.270195 -4.129463 2.561602
H -2.936614 -4.868180 3.141451


