%chk=000183583.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183583

0 1
Cl 4.909231 1.819372 -0.176480
F 0.021711 2.976761 -0.455405
F 4.935674 -2.600433 -0.342127
F 3.551799 -2.695864 1.253757
O -1.805409 2.317310 0.770525
O -0.679734 -1.928718 -0.730736
O 3.927812 -0.794580 0.221885
N -0.852396 0.313206 -0.023477
C -3.185215 0.343323 0.224352
C -2.854650 -0.889840 -0.212122
C -4.565687 0.808666 0.496519
C -3.817048 -1.986544 -0.473393
C -5.525194 -0.395273 0.569487
C -5.251611 -1.426572 -0.538010
C -1.950549 1.194179 0.388940
C -1.361226 -1.002561 -0.385602
C 0.525756 0.685722 -0.058964
C 1.518977 -0.297405 0.110151
C 0.933093 2.023461 -0.269560
C 2.863398 0.073397 0.056499
C 2.279164 2.399134 -0.291987
C 3.253744 1.415154 -0.136063
C 3.712468 -2.186353 0.020212
H -4.608170 1.397578 1.437970
H -4.883914 1.513011 -0.304727
H -3.565237 -2.519889 -1.414953
H -3.733579 -2.752329 0.330032
H -5.430537 -0.881641 1.560590
H -6.571004 -0.040231 0.501025
H -5.420081 -0.959819 -1.528750
H -5.977762 -2.258144 -0.463435
H 1.223293 -1.334188 0.288911
H 2.566989 3.444670 -0.439483
H 2.913792 -2.474562 -0.688883


%chk=000183583-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183583

0 1
Cl 4.998448 1.897033 -0.371845
F -0.045356 2.844224 -1.081206
F 5.004225 -2.727280 0.425533
F 2.989283 -2.661683 1.485905
O -1.712219 2.105857 1.238753
O -0.742628 -1.757383 -1.282333
O 3.949088 -0.741743 0.542236
N -0.840629 0.311002 -0.083493
C -3.151293 0.292985 0.336132
C -2.867281 -0.836580 -0.381266
C -4.516218 0.673456 0.831151
C -3.880541 -1.858522 -0.809946
C -5.475521 -0.542454 0.721463
C -5.313656 -1.287764 -0.630494
C -1.882798 1.059326 0.576782
C -1.396192 -0.881584 -0.667095
C 0.529887 0.680350 -0.142858
C 1.536832 -0.228303 0.255058
C 0.926493 1.951735 -0.615944
C 2.896520 0.129825 0.157935
C 2.271756 2.346996 -0.662534
C 3.262177 1.425394 -0.279169
C 3.738062 -2.123970 0.377512
H -4.455249 1.047154 1.870852
H -4.897945 1.525546 0.231796
H -3.697873 -2.162649 -1.858027
H -3.751206 -2.780071 -0.205904
H -5.265977 -1.246877 1.550614
H -6.520168 -0.202916 0.842743
H -5.532163 -0.585599 -1.459214
H -6.050363 -2.108632 -0.700206
H 1.246464 -1.201537 0.657847
H 2.535470 3.344537 -1.021534
H 3.208468 -2.399877 -0.552546


