%chk=000213488.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213488

0 1
Cl 7.085826 -0.920738 -2.191929
Cl -5.922122 -1.574399 -2.540056
Cl -4.884228 -2.456896 -0.029914
Cl -3.195366 -1.053267 -1.839115
O -0.619743 -3.990524 0.006735
O -4.307931 0.394363 0.482129
O 2.766502 2.889173 1.195775
O -3.061866 1.740212 -0.846962
N 1.347038 1.139989 0.817038
C -0.922268 0.911546 1.145519
C -0.393820 -0.387907 0.763510
C 0.122594 1.813646 1.176888
C 1.018270 -0.242240 0.580317
C -2.344077 1.178199 1.462355
C -1.015523 -1.626513 0.576336
C 1.825956 -1.346716 0.272964
C 0.104776 3.251968 1.497079
C 2.618787 1.782706 0.720672
C -0.195056 -2.700845 0.231803
C 1.213880 -2.577100 0.093783
C 3.705098 1.056940 -0.001961
C -3.179314 1.185567 0.210523
C 3.588034 0.808994 -1.377958
C 4.870612 0.707005 0.694762
C 4.638951 0.195740 -2.063140
C 5.922987 0.086089 0.017752
C -5.244321 0.164919 -0.582082
C -2.047895 -4.228563 -0.053761
C 5.789444 -0.158422 -1.351925
C -4.832569 -1.160960 -1.225462
H -2.727356 0.408772 2.178977
H -2.472363 2.156261 1.981573
H -2.089806 -1.726638 0.699883
H 2.906700 -1.258797 0.178669
H 0.511955 3.862474 0.670353
H 0.747548 3.484047 2.367174
H -0.906816 3.622203 1.710073
H 1.792180 -3.465909 -0.154024
H 2.676914 1.089388 -1.911974
H 4.957734 0.923094 1.761964
H 4.563475 -0.002982 -3.133238
H 6.834261 -0.196050 0.546702
H -6.226169 0.099600 -0.072227
H -5.231027 0.999671 -1.316349
H -2.484149 -3.669501 -0.888594
H -2.522309 -3.973626 0.897920
H -2.087725 -5.309474 -0.238160


%chk=000213488-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213488

0 1
Cl 7.071868 -0.088672 -2.920920
Cl -6.320323 -0.843793 -3.093186
Cl -5.575941 -2.372804 -0.585903
Cl -3.395686 -1.311007 -2.406112
O -0.696758 -4.233391 0.248168
O -4.202381 0.318915 0.206433
O 2.977910 2.409372 1.907013
O -2.919093 2.063888 -0.692234
N 1.407478 0.927628 0.997513
C -0.863433 0.757386 1.256344
C -0.351475 -0.557502 0.898244
C 0.208753 1.640193 1.330618
C 1.063820 -0.443274 0.747674
C -2.316809 1.075075 1.506931
C -1.000581 -1.806882 0.731999
C 1.861281 -1.581603 0.496927
C 0.202812 3.114479 1.613104
C 2.715319 1.494218 1.074755
C -0.200589 -2.934392 0.443705
C 1.216785 -2.821511 0.340918
C 3.744894 1.019038 0.096738
C -3.119189 1.242956 0.220428
C 3.407642 0.625347 -1.225275
C 5.110129 1.093521 0.477010
C 4.418165 0.294813 -2.151798
C 6.129060 0.747826 -0.432328
C -5.102987 0.369060 -0.953329
C -2.147732 -4.419600 0.335052
C 5.763976 0.352075 -1.735992
C -5.077928 -0.966849 -1.703732
H -2.791390 0.285263 2.113166
H -2.409468 2.024098 2.065905
H -2.087490 -1.881019 0.827819
H 2.949413 -1.527730 0.422938
H 0.741285 3.679970 0.831054
H 0.698865 3.351516 2.569219
H -0.834398 3.486691 1.635654
H 1.791639 -3.729627 0.137891
H 2.359322 0.586904 -1.536424
H 5.359240 1.433938 1.487021
H 4.165408 0.000661 -3.174155
H 7.181880 0.790459 -0.140259
H -6.122926 0.541288 -0.571097
H -4.798291 1.182813 -1.637090
H -2.678576 -3.811940 -0.422223
H -2.525321 -4.164344 1.344756
H -2.312475 -5.488953 0.137457


