%chk=000293454.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000293454

0 1
Cl -2.113504 1.495639 1.377345
F -0.625863 -0.994478 1.479587
F -1.602635 -2.089677 -0.062876
F -2.683405 -1.422129 1.637005
F -3.766273 -0.536813 -1.501742
F -3.833795 1.532934 -1.032968
F -4.476446 0.113482 0.390169
N 1.144321 -0.278668 -0.918999
C -2.079651 0.303832 0.062101
C -1.063263 0.700792 -1.011075
C 0.370294 0.737427 -0.535442
C -1.748175 -1.044338 0.754298
C -3.520804 0.335482 -0.518602
C 0.854186 1.840492 0.244577
C 2.477259 -0.285909 -0.524293
C 3.027956 0.763497 0.266285
C 2.168070 1.841794 0.640979
C 3.305246 -1.384739 -0.929570
C 4.404735 0.695138 0.643662
C 4.621674 -1.415464 -0.548647
C 5.177498 -0.366527 0.245328
H -1.138289 -0.006783 -1.878490
H -1.317107 1.701950 -1.432148
H 0.183266 2.655600 0.507119
H 2.573977 2.658038 1.240182
H 2.856002 -2.175148 -1.533523
H 4.821763 1.497976 1.250491
H 5.267515 -2.242759 -0.844368
H 6.227951 -0.429441 0.527918


%chk=000293454-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000293454

0 1
Cl -2.211615 1.499918 1.561334
F -0.665773 -1.090524 1.524143
F -1.618505 -2.073701 -0.282498
F -2.863640 -1.598244 1.545633
F -3.637419 -0.636409 -1.577674
F -3.779811 1.580422 -1.132129
F -4.605631 0.081771 0.337877
N 1.131863 -0.278586 -0.838635
C -2.131438 0.284258 0.119655
C -1.077957 0.737518 -0.927316
C 0.376903 0.778464 -0.477707
C -1.820433 -1.117860 0.730998
C -3.546985 0.319499 -0.541371
C 0.902789 1.910125 0.232785
C 2.473748 -0.284199 -0.483743
C 3.084899 0.807115 0.249318
C 2.249430 1.918122 0.594973
C 3.273248 -1.409944 -0.860130
C 4.475651 0.734276 0.582499
C 4.627565 -1.454662 -0.519891
C 5.232704 -0.377409 0.205353
H -1.140601 0.032748 -1.776575
H -1.393666 1.734520 -1.278456
H 0.245235 2.747105 0.483035
H 2.676846 2.768035 1.139409
H 2.786304 -2.220310 -1.410888
H 4.936938 1.560129 1.137349
H 5.235966 -2.319285 -0.806411
H 6.295889 -0.431690 0.463365


