%chk=000207230.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207230

0 1
Cl -3.108654 2.322932 1.846668
O 0.370136 -0.190579 0.911849
O -0.771529 -0.629386 -1.021670
N 4.326292 0.916745 0.439819
N -1.864396 -0.260308 1.038391
C 4.092923 -0.449428 1.000558
C 3.489869 1.118092 -0.784409
C 2.608568 -0.708188 1.362923
C 1.976582 0.941565 -0.510759
C 4.640749 -1.471672 -0.022013
C 4.015391 0.152174 -1.871102
C 1.669485 -0.368960 0.208589
C 4.031605 -1.313980 -1.420858
C 4.129950 1.993683 1.452369
C -0.772997 -0.365370 0.162505
C -3.200889 -0.057618 0.549808
C -3.857603 -1.040638 -0.230483
C -3.897253 1.116693 0.898091
C -5.181968 -0.802761 -0.635718
C -3.173254 -2.302031 -0.623665
C -5.214576 1.336450 0.502564
C -5.853570 0.365980 -0.275245
H 4.695232 -0.542175 1.942005
H 3.654387 2.167651 -1.143533
H 2.466970 -1.759720 1.671620
H 2.329499 -0.103540 2.250425
H 1.607238 1.791346 0.096773
H 1.406256 0.988248 -1.459456
H 5.739954 -1.333970 -0.088481
H 4.476831 -2.497859 0.351600
H 3.409534 0.260710 -2.788796
H 5.046969 0.461978 -2.137001
H 1.551010 -1.215072 -0.506835
H 4.606138 -1.919641 -2.147462
H 3.001181 -1.725959 -1.436618
H 3.111128 2.068553 1.861018
H 4.392985 2.962504 0.997898
H 4.828630 1.830026 2.288403
H -1.670659 0.074365 1.990260
H -5.693718 -1.549888 -1.243271
H -2.369264 -2.090994 -1.359344
H -2.685414 -2.787721 0.234590
H -3.847487 -3.035808 -1.079721
H -5.732291 2.251373 0.789179
H -6.881569 0.525700 -0.600665


%chk=000207230-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207230

0 1
Cl -3.353301 2.525515 1.755726
O 0.310420 -0.111236 0.959798
O -0.804184 -0.583614 -1.067686
N 4.400034 0.841645 0.469485
N -1.945988 -0.008909 0.931051
C 4.122797 -0.535804 0.963493
C 3.569177 1.126769 -0.733797
C 2.620426 -0.713607 1.377218
C 2.035603 1.032877 -0.416876
C 4.626207 -1.544740 -0.102331
C 4.048589 0.205884 -1.886146
C 1.642109 -0.290886 0.269935
C 4.035368 -1.298976 -1.514342
C 4.376957 1.892183 1.504295
C -0.824042 -0.265521 0.147226
C -3.293496 0.027444 0.472079
C -3.895361 -1.060532 -0.234541
C -4.097759 1.154690 0.789841
C -5.247062 -0.930700 -0.642395
C -3.140980 -2.345017 -0.504586
C -5.442853 1.267868 0.407197
C -6.015643 0.212157 -0.336507
H 4.729750 -0.688436 1.877661
H 3.773209 2.172799 -1.036216
H 2.426002 -1.759871 1.677904
H 2.424643 -0.080661 2.264429
H 1.770771 1.861374 0.269429
H 1.443713 1.167055 -1.340278
H 5.726411 -1.434972 -0.150637
H 4.410479 -2.579395 0.229610
H 3.430697 0.382654 -2.787929
H 5.085454 0.507977 -2.128477
H 1.488052 -1.085975 -0.477253
H 4.621594 -1.867849 -2.261374
H 3.005708 -1.696420 -1.575446
H 3.383682 2.066861 1.984856
H 4.703962 2.848584 1.056694
H 5.094355 1.630639 2.303655
H -1.745245 0.430893 1.833899
H -5.706925 -1.759823 -1.191618
H -2.408262 -2.209051 -1.319436
H -2.567911 -2.664152 0.385809
H -3.839221 -3.153753 -0.778402
H -6.019543 2.157775 0.673471
H -7.059991 0.279757 -0.657691


