%chk=000213951.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213951

0 1
Cl -2.496833 -1.097761 4.659496
O 0.424703 3.006536 -1.049298
O -2.870591 1.949985 -2.777202
O 4.803416 -1.207263 0.457426
O 5.263841 -0.892422 -1.632219
N -2.360222 1.718562 -0.572388
N -2.179551 -1.164759 -1.585942
N 4.621289 -0.657793 -0.622169
C -2.384557 0.996467 0.664517
C -1.897935 3.137219 -0.559212
C -2.012901 -0.364897 0.755114
C -1.608565 -1.184842 -0.423293
C -2.828467 1.209553 -1.817612
C -3.284054 -0.242264 -1.858280
C -0.500784 3.309238 0.040171
C -2.787571 1.689721 1.831651
C -2.054929 -1.005640 2.006184
C -0.472638 -2.131917 -0.237108
C -2.823145 1.049016 3.063836
C -2.453371 -0.300059 3.137255
C 0.679122 -1.715695 0.449353
C -0.538064 -3.426645 -0.774683
C 1.443960 2.126996 -0.838302
C 1.761458 -2.586792 0.587299
C 0.543837 -4.298395 -0.620662
C 1.693523 -3.879533 0.055694
C 1.867534 1.668400 0.422636
C 2.088271 1.726309 -2.033979
C 2.927745 0.770987 0.486020
C 3.139074 0.829790 -1.957829
C 3.549846 0.338490 -0.697666
H -2.630871 3.773370 -0.014456
H -1.882219 3.506561 -1.625542
H -4.166221 -0.400783 -1.195809
H -3.631346 -0.466615 -2.903712
H -0.318051 2.673431 0.923608
H -0.290813 4.367948 0.285748
H -3.096944 2.733469 1.765433
H -1.769528 -2.060710 2.086416
H -3.140941 1.583749 3.961265
H 0.729921 -0.710367 0.865445
H -1.425887 -3.744405 -1.323900
H 2.668494 -2.259124 1.101334
H 0.492606 -5.303328 -1.037887
H 2.541012 -4.556288 0.165126
H 1.380850 2.007539 1.334192
H 1.732706 2.116097 -2.988824
H 3.281665 0.391298 1.452114
H 3.654024 0.484369 -2.862760


%chk=000213951-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213951

0 1
Cl -2.646875 -1.160521 4.831061
O 0.263851 1.947793 -1.025650
O -3.248516 1.962553 -2.741705
O 6.384809 0.983932 0.552949
O 6.116126 -0.521464 -1.142403
N -2.549294 1.706781 -0.523479
N -2.632143 -1.138503 -1.543614
N 5.669745 0.406875 -0.359282
C -2.585494 0.986200 0.716022
C -1.851415 3.013380 -0.587589
C -2.259963 -0.406127 0.796453
C -1.942576 -1.221209 -0.421475
C -3.186452 1.253943 -1.702252
C -3.750680 -0.170619 -1.616497
C -0.391902 2.920444 -0.135878
C -2.897829 1.698421 1.906053
C -2.286654 -1.044099 2.067861
C -0.815970 -2.204362 -0.373049
C -2.914515 1.061277 3.159974
C -2.612361 -0.314930 3.219843
C 0.282057 -2.035777 0.514144
C -0.810695 -3.307842 -1.270118
C 1.599786 1.627844 -0.798196
C 1.356633 -2.951316 0.507998
C 0.259551 -4.224010 -1.270315
C 1.348107 -4.050504 -0.380375
C 2.415169 2.243039 0.190321
C 2.126873 0.613456 -1.642427
C 3.755652 1.839299 0.330222
C 3.461144 0.211769 -1.502986
C 4.266421 0.829632 -0.513792
H -2.365187 3.782635 0.020956
H -1.908199 3.330869 -1.642687
H -4.434596 -0.242855 -0.742396
H -4.317690 -0.353962 -2.540150
H -0.305024 2.579435 0.915119
H 0.086819 3.915422 -0.235771
H -3.156568 2.760224 1.847093
H -2.050847 -2.109561 2.137368
H -3.170927 1.616576 4.066511
H 0.311161 -1.177077 1.193480
H -1.652773 -3.417659 -1.960187
H 2.201535 -2.803031 1.189212
H 0.248460 -5.074060 -1.961379
H 2.180628 -4.762717 -0.382413
H 2.022254 3.028762 0.840909
H 1.466652 0.155823 -2.384317
H 4.412360 2.291976 1.077883
H 3.891247 -0.569351 -2.134450


