%chk=000191262.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191262

0 1
Cl 0.802019 -1.119472 3.203562
O -0.637288 -2.411461 1.127393
O 0.821672 -0.739634 -2.946451
O 3.300877 -0.209097 -1.737048
N -1.722223 -1.518256 -1.326490
N 1.614808 -1.592586 -0.943423
N -6.565967 3.038299 -1.112889
N 4.487908 -2.248057 0.315856
C -1.434328 -0.571410 -0.220075
C -2.747208 0.104986 0.230071
C -3.350592 0.960462 -0.892295
C -0.576724 -2.375465 -1.772525
C -4.643795 1.642672 -0.435099
C -0.747463 -1.215386 1.003152
C -5.277768 2.446867 -1.582531
C -0.959093 -3.034827 -3.097671
C 0.659885 -1.477846 -2.013343
C 3.566596 -1.103954 0.509774
C -0.164752 -0.242026 2.005955
C 4.246163 0.221668 0.918126
C 2.859161 -0.902672 -0.855146
C 3.231254 1.251286 1.332904
C 2.629954 2.073030 0.366100
C 2.877492 1.396664 2.682548
C 1.694870 3.036523 0.749095
C 1.944127 2.366553 3.061070
C 1.351330 3.187426 2.097087
H -0.741092 0.215837 -0.635901
H -3.481303 -0.659620 0.555661
H -2.557392 0.740401 1.117096
H -3.544242 0.325514 -1.782953
H -2.615204 1.716002 -1.231200
H -2.513682 -2.127510 -1.082629
H -0.341144 -3.177071 -1.016670
H -4.447807 2.303182 0.430350
H -5.375532 0.889852 -0.075217
H -4.558719 3.203956 -1.963043
H -5.507443 1.768341 -2.435403
H -0.142907 -3.655697 -3.486173
H -1.845761 -3.670689 -2.997065
H -1.186794 -2.274563 -3.863786
H 2.825879 -1.387718 1.308165
H -0.964321 0.314614 2.537379
H 0.488169 0.518636 1.518760
H 1.437781 -2.313296 -0.224381
H 4.967975 0.035822 1.738011
H 4.856380 0.609199 0.070218
H -6.403576 3.709766 -0.369263
H -7.021154 3.538199 -1.870493
H 5.232697 -2.019404 -0.339773
H 4.922005 -2.518636 1.193705
H 2.898407 1.958069 -0.688764
H 3.325152 0.754748 3.439307
H 1.239670 3.677715 -0.005127
H 1.681762 2.482090 4.111871
H 0.633480 3.948676 2.394910


%chk=000191262-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191262

0 1
Cl 1.087189 -2.311764 2.400538
O -2.250543 -2.868719 1.669388
O 0.489929 -1.127377 -3.087469
O 3.049677 0.023423 -2.298609
N -1.681568 -1.778409 -0.955433
N 1.653132 -1.417225 -1.051817
N -5.215665 3.916140 -1.602770
N 5.013805 -1.182879 -0.514292
C -1.535122 -0.984363 0.271124
C -2.717478 0.022385 0.417679
C -2.762060 1.058001 -0.726463
C -0.515053 -2.593564 -1.370476
C -3.983595 1.995095 -0.616159
C -1.513170 -1.854617 1.551528
C -4.027774 3.050066 -1.741859
C -0.947713 -3.592805 -2.458103
C 0.573719 -1.642426 -1.951750
C 3.766661 -0.560526 -0.042008
C -0.584981 -1.437243 2.695722
C 3.928571 0.929624 0.438641
C 2.794238 -0.611946 -1.244861
C 2.666329 1.530419 1.035527
C 1.728143 2.215510 0.217456
C 2.384839 1.400356 2.421710
C 0.547763 2.761529 0.770616
C 1.204126 1.943625 2.978800
C 0.279998 2.629050 2.153880
H -0.597396 -0.398172 0.214839
H -3.663814 -0.555752 0.451422
H -2.631489 0.548544 1.391564
H -2.773444 0.519804 -1.692428
H -1.826459 1.653445 -0.712913
H -2.548430 -2.332743 -0.947636
H -0.079500 -3.164295 -0.511969
H -3.971458 2.513074 0.367819
H -4.924453 1.412689 -0.653894
H -3.056973 3.607416 -1.747346
H -4.096902 2.529731 -2.716330
H -0.098769 -4.222228 -2.775432
H -1.743881 -4.257428 -2.075292
H -1.319270 -3.042230 -3.338275
H 3.374937 -1.157352 0.803548
H -0.931096 -1.817694 3.666596
H -0.341150 -0.364484 2.710794
H 1.588070 -1.891901 -0.142893
H 4.745241 0.934462 1.186136
H 4.266930 1.514196 -0.437192
H -5.229662 4.466462 -0.737942
H -5.423416 4.490758 -2.424819
H 5.349828 -0.794563 -1.401847
H 5.746754 -1.274102 0.194132
H 1.931418 2.326271 -0.854616
H 3.103503 0.884753 3.070930
H -0.152410 3.305764 0.126254
H 1.017311 1.853844 4.055621
H -0.625215 3.071076 2.585932


