%chk=000297309.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297309

0 1
Cl 0.430023 -3.156401 1.760004
P 0.452859 -2.068876 0.133336
F -0.741564 0.125240 -2.390725
F -2.508395 -0.740220 -1.612999
F -2.284818 1.373752 -1.674677
F -2.155834 2.036903 1.194790
F -3.287824 0.261063 0.965282
F -1.690719 0.320045 2.353570
O 1.652817 -1.005065 0.479375
O -0.941881 -1.168649 0.412530
O 0.485495 -2.763547 -1.152050
C 1.561160 0.226851 -0.306787
C 2.906602 0.966630 0.012231
C 0.305240 0.981298 0.154267
C -1.005056 0.194834 0.046774
C 2.913697 2.312059 -0.728743
C 3.055944 1.178634 1.523124
C 4.047777 0.077986 -0.507158
C -1.629419 0.238513 -1.393819
C -2.038553 0.703570 1.120857
H 1.534999 -0.032030 -1.390960
H 0.478659 1.289851 1.216412
H 0.227040 1.943188 -0.401023
H 2.170755 3.013094 -0.336142
H 3.890587 2.803026 -0.623190
H 2.736857 2.195997 -1.803641
H 2.945786 0.225191 2.061454
H 2.311932 1.872623 1.925900
H 4.043801 1.580876 1.774156
H 4.004580 -0.066187 -1.591710
H 5.027803 0.508992 -0.275679
H 4.013349 -0.917940 -0.042559


%chk=000297309-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000297309

0 1
Cl 0.676761 -1.982061 2.708783
P 0.459162 -2.199621 0.460682
F -0.618683 -0.496780 -2.360169
F -2.741662 0.084043 -1.854696
F -1.131483 1.672474 -1.947341
F -2.460272 2.017768 0.593938
F -3.395978 -0.046645 0.760511
F -1.818724 0.589297 2.239260
O 1.686251 -1.203061 -0.172793
O -1.043873 -1.329480 0.171478
O 0.420764 -3.685431 -0.041349
C 1.516156 0.292626 -0.403912
C 2.864526 0.969692 -0.024441
C 0.279523 0.814239 0.351472
C -1.053024 0.118649 -0.031471
C 2.778167 2.469777 -0.428959
C 3.180455 0.838565 1.485967
C 3.983919 0.286617 -0.857347
C -1.406857 0.343852 -1.547320
C -2.202389 0.655593 0.886372
H 1.383695 0.371445 -1.498345
H 0.423803 0.675186 1.436388
H 0.174368 1.893441 0.157966
H 2.083402 3.042073 0.212743
H 3.775610 2.931851 -0.321916
H 2.465475 2.595400 -1.483083
H 3.184747 -0.218370 1.803671
H 2.460155 1.390522 2.117729
H 4.181321 1.259282 1.689274
H 3.798150 0.392903 -1.943006
H 4.957785 0.756674 -0.631466
H 4.052449 -0.789219 -0.626421


