%chk=000278693.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278693

0 1
Cl -0.961819 2.140775 -1.025029
Cl 9.124306 -1.569629 -0.360042
S 7.830148 1.406778 -0.825379
F 8.581019 1.931169 0.460223
O 8.878571 0.993672 -1.699195
O 6.926409 2.472881 -1.142344
N -5.476287 0.028727 0.176433
N -7.808666 0.293704 -0.702643
N -7.378853 -0.681834 1.498877
N -5.213227 -1.106786 2.306808
N -9.532013 -0.793772 0.495021
C -6.409266 0.697424 -0.875658
C 0.985952 -0.501945 0.107149
C 0.089573 -0.731020 -1.120525
C -4.084611 -0.168068 -0.138530
C 2.462092 -0.736950 -0.232965
C -1.357572 -0.529808 -0.776841
C -6.295881 2.215524 -0.661828
C -5.957020 0.269734 -2.275035
C 3.360615 -0.491972 0.990112
C -6.058421 -0.572703 1.312863
C -3.275469 0.950884 -0.396881
C -3.534327 -1.463420 -0.193218
C -1.932492 0.748082 -0.712020
C -2.186863 -1.631703 -0.504986
C 4.803333 -0.744795 0.653876
C -8.209303 -0.341241 0.384714
C 5.600747 0.282816 0.137664
C 5.365726 -2.020992 0.842087
C 6.948991 0.059745 -0.187410
C 6.701313 -2.258073 0.523405
C 7.483616 -1.213083 0.011473
H 0.669924 -1.171172 0.930511
H 0.841937 0.531375 0.483625
H 0.390328 -0.047933 -1.944527
H 0.253347 -1.751815 -1.523645
H 2.770763 -0.069585 -1.062697
H 2.609270 -1.768978 -0.606591
H -6.970207 2.739645 -1.354187
H -6.593645 2.508112 0.351645
H -5.278752 2.585460 -0.835860
H -6.691686 0.611401 -3.021125
H -4.983304 0.683078 -2.552436
H -5.909571 -0.822250 -2.372480
H 3.223067 0.547484 1.356468
H 3.038433 -1.136918 1.833479
H -3.697767 1.960196 -0.359411
H -4.164200 -2.332635 0.007115
H -1.769641 -2.639269 -0.545126
H 5.161863 1.278509 -0.022232
H 4.752125 -2.832472 1.239351
H -5.680002 -1.388062 3.166699
H -4.320260 -0.656407 2.457963
H 7.137402 -3.248210 0.669753
H -10.215277 -0.345815 -0.101243
H -9.858367 -1.024060 1.423974


%chk=000278693-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000278693

0 1
Cl -0.903234 2.329695 -0.705651
Cl 9.371284 -1.414852 -0.469494
S 7.901231 1.658798 -0.354109
F 9.063555 1.618586 1.087927
O 8.808216 1.615188 -1.673447
O 6.886530 2.877529 -0.088510
N -5.545623 0.002561 0.084398
N -7.917434 -0.069208 -0.637816
N -7.291784 -0.131794 1.736227
N -5.060285 -0.195335 2.404997
N -9.478889 -0.550985 1.044380
C -6.584512 0.443447 -0.980647
C 0.998391 -0.646118 0.050070
C 0.106783 -0.626986 -1.223427
C -4.151987 -0.142192 -0.237611
C 2.496391 -0.799755 -0.289685
C -1.364734 -0.442811 -0.899952
C -6.614404 1.997250 -1.021180
C -6.183387 -0.135992 -2.350101
C 3.388985 -0.817726 0.983919
C -5.998364 -0.097235 1.396289
C -3.302288 0.994026 -0.302278
C -3.604191 -1.425041 -0.494131
C -1.945609 0.820442 -0.630253
C -2.239611 -1.560675 -0.818605
C 4.864638 -0.952916 0.652422
C -8.192556 -0.226358 0.651294
C 5.645644 0.193981 0.368571
C 5.494608 -2.221964 0.575276
C 6.997878 0.043789 0.016992
C 6.855538 -2.356739 0.228432
C 7.629155 -1.211569 -0.055714
H 0.674415 -1.476824 0.709080
H 0.841498 0.292191 0.616738
H 0.453946 0.189934 -1.883896
H 0.245757 -1.576625 -1.774144
H 2.815202 0.034448 -0.946327
H 2.659935 -1.733189 -0.865531
H -7.402309 2.321169 -1.722929
H -6.855906 2.402324 -0.022171
H -5.649358 2.414667 -1.362915
H -6.961127 0.154053 -3.075275
H -5.208054 0.245916 -2.698727
H -6.154068 -1.237770 -2.307138
H 3.209991 0.114362 1.553070
H 3.071151 -1.657369 1.631623
H -3.703210 1.990377 -0.097019
H -4.260223 -2.299425 -0.443130
H -1.829470 -2.556290 -1.025207
H 5.213274 1.199534 0.425699
H 4.913687 -3.124103 0.798074
H -5.416799 -0.331880 3.347389
H -4.066559 -0.069301 2.234563
H 7.328491 -3.342169 0.183767
H -10.207197 -0.629913 0.341015
H -9.656900 -0.749357 2.024008


