%chk=000227464.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227464

0 1
Cl 2.640329 -4.146286 0.863376
Cl -3.553655 3.613049 -0.936472
N 3.532233 2.782437 0.016358
N 1.725988 -1.541716 -0.269337
N 1.049008 2.643198 0.172761
N 0.234256 0.307923 0.013802
N 4.572907 1.892023 -0.137989
N -1.235554 2.195125 0.289803
C 2.615076 0.714427 -0.113338
C 2.309077 2.119526 0.038702
C 1.504313 -0.176350 -0.121396
C 4.046795 0.651774 -0.217429
C 0.056244 1.684244 0.154363
C 0.729562 -2.567840 -0.271328
C 3.775123 4.226217 0.134454
C -2.446355 1.440665 0.280692
C 1.069757 -3.849385 0.216576
C -0.564054 -2.367747 -0.786849
C -3.614783 2.034589 -0.248128
C -2.541431 0.148110 0.830163
C 0.154758 -4.902154 0.192116
C -1.479676 -3.420790 -0.802756
C -1.127507 -4.685084 -0.318218
C -4.839920 1.366970 -0.230768
C -3.766125 -0.519699 0.837638
C -4.914862 0.082269 0.312147
H 4.656188 -0.229027 -0.341671
H 2.704755 -1.847116 -0.283425
H 4.412294 4.443018 1.012264
H 4.289508 4.609128 -0.766849
H 2.812044 4.760407 0.250759
H -1.312423 3.222740 0.299833
H -0.859152 -1.384953 -1.170887
H -1.654036 -0.337829 1.248471
H 0.441582 -5.883532 0.573204
H -2.480154 -3.251660 -1.203589
H -1.848996 -5.500277 -0.338398
H -5.728301 1.847677 -0.643181
H -3.825369 -1.521259 1.265356
H -5.866145 -0.446515 0.326872


%chk=000227464-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227464

0 1
Cl 3.091388 -4.205926 0.588348
Cl -3.483168 4.074923 -0.705242
N 3.459069 2.746822 0.014201
N 1.707343 -1.596633 0.017295
N 1.006864 2.590271 0.004401
N 0.198695 0.263730 0.016889
N 4.556905 1.868498 0.030477
N -1.259352 2.166023 0.001559
C 2.587217 0.666312 0.036214
C 2.259638 2.061766 0.017295
C 1.468391 -0.229423 0.022209
C 4.020733 0.617571 0.040930
C 0.026442 1.631908 0.014322
C 0.827271 -2.690188 -0.130791
C 3.666634 4.191874 -0.000347
C -2.522128 1.562771 0.136023
C 1.329818 -4.003862 0.092744
C -0.532974 -2.578379 -0.533639
C -3.686079 2.334747 -0.147831
C -2.731946 0.228166 0.587116
C 0.546771 -5.156924 -0.058538
C -1.330456 -3.730095 -0.687490
C -0.805469 -5.020444 -0.450093
C -4.988042 1.831195 -0.012376
C -4.035171 -0.289545 0.723210
C -5.169798 0.498250 0.423684
H 4.694777 -0.237970 0.051010
H 2.686964 -1.864843 0.155388
H 4.224014 4.508198 0.897267
H 4.233682 4.488331 -0.898655
H 2.677058 4.674720 -0.010916
H -1.256669 3.183366 -0.130340
H -0.934304 -1.583149 -0.725474
H -1.857430 -0.375359 0.831602
H 0.984522 -6.141719 0.126946
H -2.372518 -3.612482 -1.003338
H -1.429098 -5.911649 -0.569194
H -5.844222 2.470412 -0.245473
H -4.161312 -1.318240 1.078127
H -6.180762 0.093274 0.530181


