%chk=000115797.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000115797

0 1
Br -5.943829 1.674900 0.417843
Br -7.155835 -1.697894 -0.427564
Cl -0.356766 -2.339646 1.400920
Cl 4.887141 2.133270 1.885554
Cl 5.845805 -1.216527 -0.131759
P 1.858311 0.479070 -0.870587
O 0.717009 0.203133 0.281217
O 2.617331 1.704992 -0.078585
O 2.872608 -0.797393 -0.720230
O 1.407042 0.705541 -2.248118
C -3.449254 0.227473 0.570219
C -2.697450 -1.064364 0.961527
C -2.877355 0.799929 -0.739484
C -0.612747 -0.165871 -0.182828
C -1.206260 -0.779490 1.098319
C -1.379663 1.091717 -0.609831
C -4.963127 -0.054618 0.501436
C -5.369141 -0.928364 -0.669416
C 3.906778 2.093374 -0.629100
C 3.256582 -1.166272 0.635834
C 4.437478 3.054560 0.422371
C 4.405678 -2.131783 0.403861
H -3.278215 0.984090 1.383010
H -2.871406 -1.859831 0.207250
H -3.089805 -1.473543 1.914872
H -3.049064 0.102367 -1.581817
H -3.408830 1.735440 -1.012362
H -0.544731 -0.912451 -1.007791
H -0.977940 -0.124384 1.974755
H -0.987648 1.467386 -1.581958
H -1.198425 1.910290 0.116530
H -5.298559 -0.501672 1.470670
H -4.675233 -1.784618 -0.789732
H -5.387912 -0.377302 -1.630063
H 4.562464 1.204579 -0.759120
H 3.745325 2.603877 -1.601489
H 3.559304 -0.269759 1.218660
H 2.389114 -1.665403 1.120036
H 3.654984 3.785150 0.719319
H 5.331389 3.602472 0.070302
H 4.156408 -2.855059 -0.402169
H 4.672844 -2.688364 1.321297


%chk=000115797-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000115797

0 1
Br -6.154091 1.525978 0.843895
Br -7.388252 -1.650586 -0.664273
Cl -0.312996 -2.508027 1.141437
Cl 5.033275 2.384908 1.831800
Cl 6.101523 -1.274992 0.035973
P 1.907771 0.404457 -0.933656
O 0.679870 0.354387 0.275565
O 2.722312 1.790035 -0.304683
O 2.971292 -0.910579 -0.606689
O 1.411524 0.411993 -2.437154
C -3.580892 0.114059 0.598290
C -2.761209 -1.203325 0.772500
C -3.020341 0.926720 -0.593754
C -0.696467 -0.029466 -0.140140
C -1.278720 -0.868938 0.997655
C -1.527070 1.253232 -0.362194
C -5.096862 -0.200795 0.521930
C -5.547471 -0.830299 -0.795062
C 4.083619 2.113350 -0.807536
C 3.383334 -1.212517 0.792979
C 4.658789 3.141920 0.146621
C 4.567112 -2.153531 0.697192
H -3.439707 0.716640 1.518774
H -2.849186 -1.841361 -0.127827
H -3.134518 -1.790657 1.630990
H -3.130792 0.348731 -1.533804
H -3.591102 1.864568 -0.716267
H -0.658568 -0.623800 -1.074889
H -1.102394 -0.375371 1.967003
H -1.107215 1.794556 -1.228934
H -1.413209 1.906972 0.523826
H -5.398386 -0.824845 1.379648
H -4.891916 -1.673919 -1.068566
H -5.606096 -0.105508 -1.618870
H 4.710912 1.203501 -0.856136
H 3.996772 2.559382 -1.818520
H 3.637626 -0.283367 1.336134
H 2.540413 -1.721400 1.300034
H 3.948128 3.958928 0.336574
H 5.617951 3.530898 -0.228249
H 4.373163 -2.979525 -0.001773
H 4.846475 -2.533407 1.691955


