%chk=000248618.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248618

0 1
Cl 4.106129 -1.630320 -2.281632
Cl 8.042440 0.157544 0.883909
N 1.341646 0.230742 0.340682
C -3.350261 -1.214531 1.418227
C -2.252972 -0.471636 0.691094
C -2.815726 0.394883 -0.300397
C -4.607096 -0.699219 0.755060
C -4.276265 0.253025 -0.259953
C -0.887244 -0.545050 0.881939
C -1.995813 1.183406 -1.093379
C -5.926222 -1.029401 1.012204
C -5.273988 0.863395 -1.005568
C -0.059783 0.259064 0.059278
C -0.604863 1.109847 -0.915172
C -6.932743 -0.405439 0.250681
C -6.612773 0.523253 -0.739278
C 2.228712 0.051540 -0.585118
C 3.661207 0.067397 -0.210440
C 4.608677 -0.665364 -0.945380
C 4.109813 0.822785 0.889331
C 5.967411 -0.652367 -0.623907
C 5.462793 0.855496 1.232015
C 6.372097 0.118670 0.468233
H -3.340392 -1.001023 2.504501
H -3.246598 -2.311156 1.310682
H -0.443292 -1.188540 1.638829
H -2.416293 1.848986 -1.844692
H -6.188325 -1.751105 1.780999
H -5.032877 1.588460 -1.778488
H 0.045948 1.731264 -1.525976
H -7.975160 -0.655575 0.442105
H -7.406389 0.994481 -1.316637
H 2.020073 -0.118351 -1.656182
H 3.380212 1.383875 1.483856
H 6.689343 -1.228481 -1.205871
H 5.803873 1.444145 2.084743


%chk=000248618-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248618

0 1
Cl 4.312055 -0.093407 -2.988477
Cl 8.199806 0.115260 0.937811
N 1.351411 0.101373 0.368011
C -3.435274 -0.830730 1.728295
C -2.299712 -0.337056 0.839219
C -2.832877 0.226553 -0.362881
C -4.678632 -0.489671 0.914022
C -4.301711 0.133648 -0.316600
C -0.918674 -0.361391 1.065100
C -1.964336 0.770414 -1.337716
C -6.033675 -0.704572 1.218536
C -5.286120 0.542550 -1.244936
C -0.034608 0.152062 0.071021
C -0.573538 0.729344 -1.121411
C -7.020589 -0.294083 0.286553
C -6.647843 0.323617 -0.934086
C 2.263991 0.052232 -0.573693
C 3.696040 0.069617 -0.230822
C 4.724641 0.007961 -1.208449
C 4.107434 0.148616 1.133013
C 6.093022 0.020559 -0.878113
C 5.462756 0.162328 1.501798
C 6.439474 0.097601 0.484192
H -3.435510 -0.326775 2.714730
H -3.358337 -1.917318 1.929431
H -0.483003 -0.771256 1.982043
H -2.362505 1.230536 -2.248914
H -6.329918 -1.181482 2.159999
H -5.005624 1.020752 -2.190258
H 0.102020 1.178239 -1.858469
H -8.081167 -0.454931 0.510163
H -7.424630 0.633945 -1.641889
H 2.017618 -0.030952 -1.648357
H 3.313579 0.197321 1.884872
H 6.859018 -0.028088 -1.655352
H 5.760717 0.221887 2.551911


