%chk=000188321.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188321

0 1
Cl -2.777062 3.642027 -1.451286
P 2.973892 1.685859 -0.552041
O 1.792777 -1.004151 1.119982
O -0.032334 -3.477253 1.833080
O 1.581048 -4.009103 -0.017118
O 3.266000 0.160110 -1.106547
O 2.649319 1.477938 1.041645
O 1.447499 1.934715 -1.139198
O 3.982844 2.682630 -0.882908
N -0.306583 0.071242 0.995181
N -0.872769 2.309210 0.874853
N -1.458428 -0.688449 -1.112398
N -2.660069 1.127933 -2.220678
C -0.075429 -2.463366 0.851430
C 0.954020 -2.752532 -0.285433
C 0.404993 -1.123025 1.481247
C 2.080574 -1.705776 -0.125313
C 2.143089 -0.720298 -1.299794
C -1.078037 0.226805 -0.168836
C -0.189635 1.396240 1.562396
C -1.451189 1.628305 -0.213191
C -2.268187 2.028357 -1.289245
C -2.242962 -0.177737 -2.099230
H -1.138566 -2.457552 0.518400
H 0.480639 -2.763913 -1.288213
H 0.415414 -1.132321 2.600415
H 3.075464 -2.172308 0.079849
H 1.190884 -0.176892 -1.464528
H 2.415946 -1.255204 -2.237862
H 0.907769 -3.786813 1.979101
H 0.945811 -4.748374 -0.180811
H 0.417717 1.575970 2.445824
H -2.583330 -0.871834 -2.887827
H 2.668434 0.534074 1.401694
H 1.074448 2.852885 -1.095938


%chk=000188321-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188321

0 1
Cl -3.234712 3.597030 -1.353536
P 3.213140 1.633516 -0.634387
O 1.788510 -0.805938 1.045976
O 0.302936 -3.296916 2.148147
O 1.410146 -4.066669 -0.102990
O 3.381931 0.042570 -1.319599
O 3.257093 1.390403 1.045340
O 1.525329 1.923915 -0.986412
O 4.225779 2.705334 -1.186400
N -0.458215 0.132467 1.054664
N -1.365110 2.254759 1.087556
N -1.274498 -0.597201 -1.181019
N -2.617015 1.123142 -2.279589
C -0.015616 -2.386554 1.062397
C 0.881372 -2.696390 -0.193561
C 0.399369 -0.968937 1.516603
C 2.072819 -1.710385 -0.114736
C 2.247638 -0.895466 -1.406453
C -1.141832 0.284599 -0.156994
C -0.621603 1.355561 1.742921
C -1.707735 1.606220 -0.110038
C -2.460647 1.970277 -1.246685
C -2.027295 -0.110959 -2.211626
H -1.091307 -2.445720 0.819818
H 0.285610 -2.543970 -1.109039
H 0.431308 -0.931666 2.616882
H 3.001206 -2.248281 0.138820
H 1.322405 -0.355596 -1.673274
H 2.524362 -1.583599 -2.224820
H 0.881579 -4.015247 1.759116
H 0.873341 -4.682583 -0.660453
H -0.169453 1.521302 2.719520
H -2.178028 -0.767418 -3.071954
H 2.756561 0.541730 1.303999
H 1.314631 2.874068 -1.171490


