%chk=000214729.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214729

0 1
Cl 3.620561 2.277502 1.226661
Cl 5.832325 1.043174 -0.590380
O -2.326810 0.254595 -1.390912
O 0.628555 -2.993593 0.875478
N -0.424108 -1.211295 -0.154687
N -0.405978 2.129481 -0.096474
N -2.173866 3.141615 0.909316
N -0.026883 2.951351 0.921134
N -1.106406 3.555247 1.509743
C -1.784871 -1.586117 0.036604
C -2.785015 -0.760067 -0.543060
C 1.980322 -1.172628 0.083801
C -2.193382 -2.710355 0.770862
C 0.693114 -1.914686 0.322191
C -4.143305 -1.027882 -0.381562
C -3.555490 -2.977214 0.933753
C -4.526058 -2.145000 0.368057
C -2.729308 1.599500 -1.063373
C 2.179480 0.064537 0.709140
C 2.972598 -1.736638 -0.727460
C 3.376922 0.746183 0.488290
C 4.173494 -1.051360 -0.937133
C 4.370342 0.193141 -0.330511
C -1.765984 2.236488 -0.117354
H -0.285981 -0.340415 -0.695786
H -1.443090 -3.375270 1.215849
H -4.889451 -0.385430 -0.844136
H -3.860466 -3.850602 1.511467
H -3.762502 1.631480 -0.663110
H -2.684979 2.096738 -2.059548
H -5.583198 -2.367541 0.504183
H 1.411964 0.484686 1.361775
H 2.810506 -2.713459 -1.190822
H 4.953603 -1.482837 -1.568013
H 0.952145 3.099473 1.176119


%chk=000214729-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000214729

0 1
Cl 3.370865 2.575133 0.432136
Cl 6.105176 0.851399 -0.077292
O -2.309429 0.503387 -0.582673
O 0.703203 -3.323860 0.090312
N -0.479618 -1.316727 -0.172777
N -0.506364 2.386016 0.313904
N -2.029655 4.089485 0.102525
N 0.071883 3.623567 0.378326
N -0.812772 4.679940 0.258178
C -1.817728 -1.773301 -0.079771
C -2.822784 -0.770733 -0.241544
C 1.975700 -1.269276 -0.062343
C -2.220138 -3.105501 0.186464
C 0.685532 -2.058755 -0.039760
C -4.189358 -1.068017 -0.111158
C -3.596068 -3.405072 0.312412
C -4.578193 -2.398907 0.174551
C -2.919746 1.698210 0.011444
C 2.045404 0.133392 0.144357
C 3.173403 -2.002091 -0.258871
C 3.299123 0.770463 0.139915
C 4.421489 -1.353085 -0.268041
C 4.489685 0.043194 -0.068720
C -1.821798 2.712848 0.141103
H -0.416988 -0.307750 -0.354593
H -1.454417 -3.874937 0.298475
H -4.941700 -0.283791 -0.248921
H -3.898302 -4.436289 0.522633
H -3.353466 1.451830 1.001310
H -3.719000 2.101853 -0.636793
H -5.640422 -2.643834 0.275423
H 1.153045 0.740684 0.331571
H 3.099898 -3.085443 -0.391680
H 5.345873 -1.915882 -0.425483
H 1.086466 3.734651 0.475484


