%chk=000260057.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260057

0 1
Cl 6.254852 -0.445996 -0.345806
Cl -6.140185 -1.666425 -1.713288
S -3.397783 -0.032788 0.241843
N -0.611478 -0.117956 0.089441
N -0.295450 -2.358481 0.174397
N -1.614103 -2.135227 0.247009
C -0.326964 1.343698 0.038130
C -0.830985 2.044742 1.314192
C -0.934012 1.968993 -1.232245
C -0.484215 3.538334 1.249425
C -0.588243 3.463185 -1.285454
C -1.055997 4.190368 -0.017095
C 0.355786 -1.162310 0.071842
C -1.838255 -0.786537 0.198806
C 1.801570 -0.974046 -0.037964
C 2.353026 -0.331564 -1.159401
C 2.635696 -1.474367 0.976644
C -4.517971 -1.450414 0.470396
C 3.735863 -0.165707 -1.257885
C 4.019735 -1.312779 0.883920
C 4.547126 -0.655870 -0.230723
C -4.706124 -2.250766 -0.796793
H 0.794071 1.452274 -0.004985
H -1.926320 1.922397 1.430704
H -0.379721 1.582072 2.212280
H -0.560150 1.453079 -2.136206
H -2.035395 1.841291 -1.249530
H -0.880956 4.049281 2.147976
H 0.613867 3.676406 1.283372
H 0.502677 3.597811 -1.417521
H -1.060044 3.920327 -2.176822
H -2.162920 4.187026 0.028283
H -0.756367 5.254455 -0.061012
H 1.704103 0.023993 -1.960536
H 2.198711 -1.998671 1.829838
H -5.471746 -1.022686 0.850721
H -4.124791 -2.106062 1.281556
H 4.175986 0.329308 -2.123821
H 4.676882 -1.697704 1.664638
H -3.832877 -2.204209 -1.480212
H -4.887901 -3.322871 -0.572711


%chk=000260057-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000260057

0 1
Cl 6.401744 -0.673324 -0.489256
Cl -5.598186 -1.472041 -2.092490
S -3.476863 0.038995 0.315505
N -0.633592 -0.083136 0.136020
N -0.250660 -2.300875 0.424349
N -1.649002 -2.074619 0.506146
C -0.392294 1.387890 0.051090
C -0.915848 2.138628 1.301716
C -0.949890 1.989595 -1.262498
C -0.562561 3.643001 1.201023
C -0.608175 3.497271 -1.347866
C -1.115036 4.265504 -0.103568
C 0.342377 -1.102104 0.193619
C -1.845525 -0.746086 0.333554
C 1.795828 -0.945044 0.020437
C 2.366209 -0.102095 -0.972612
C 2.661145 -1.727370 0.833257
C -4.517777 -1.535193 0.517269
C 3.765666 -0.014040 -1.130310
C 4.060595 -1.653141 0.681764
C 4.593476 -0.786932 -0.293661
C -4.630067 -2.375367 -0.746045
H 0.707288 1.504381 0.044442
H -2.013559 2.026366 1.385144
H -0.471238 1.693289 2.211835
H -0.532426 1.445188 -2.131632
H -2.048229 1.855321 -1.298142
H -0.966044 4.175266 2.082830
H 0.539792 3.767703 1.229174
H 0.491649 3.623260 -1.430560
H -1.047631 3.923527 -2.269195
H -2.223516 4.237028 -0.081978
H -0.821855 5.330382 -0.170576
H 1.723740 0.455122 -1.662584
H 2.222425 -2.399652 1.576546
H -5.497152 -1.169709 0.865080
H -4.028228 -2.131091 1.306132
H 4.200923 0.629779 -1.899641
H 4.722759 -2.255071 1.310421
H -3.648012 -2.619742 -1.171736
H -5.203250 -3.295258 -0.547599


