%chk=000276429.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276429

0 1
Cl -0.144651 -0.173752 -3.282871
S 5.242654 -1.052713 3.422047
F 6.351361 -2.126589 3.082839
O 0.192236 -2.717473 -2.132632
O 2.412182 -3.757450 0.466984
O 5.989281 0.020691 4.009710
O 4.258851 -1.793708 4.147204
N -4.196983 0.126835 -0.120452
N -5.216042 1.722701 1.519206
N -6.601124 0.269791 0.117397
N -5.694308 -1.396443 -1.273472
N -7.560708 1.659799 1.788114
N 2.307370 -1.809213 -0.776219
C -3.958055 1.210127 0.972579
C -3.146467 0.577469 2.110727
C -3.204119 2.367335 0.302490
C -3.067078 -0.633976 -0.594499
C -5.509126 -0.300578 -0.403969
C -6.388833 1.244527 1.141413
C -2.266571 -0.091435 -1.616413
C -2.771006 -1.896508 -0.044640
C -1.165154 -0.815751 -2.063499
C -1.675977 -2.625016 -0.507568
C -0.878192 -2.084502 -1.522720
C 3.281380 -1.023648 -0.077561
C 3.775754 0.160751 -0.693597
C 0.890392 -3.733375 -1.383537
C 4.682939 -0.605749 1.854555
C 3.740498 -1.398830 1.196586
C 1.941876 -3.118221 -0.452749
C 4.716471 0.936379 -0.004687
C 5.172267 0.559170 1.260454
C 3.316154 0.588550 -2.046678
H -2.143712 0.273908 1.799575
H -3.036036 1.302424 2.932507
H -3.655090 -0.292887 2.541994
H -3.156554 3.222361 0.995200
H -2.178525 2.100421 0.036294
H -3.720084 2.724874 -0.595754
H -2.501384 0.885437 -2.047072
H -3.408215 -2.307482 0.743586
H -1.449737 -3.603518 -0.082484
H -6.659965 -1.566554 -1.550987
H -5.034695 -1.513721 -2.031210
H -7.509233 2.521405 2.315164
H -8.432961 1.502248 1.302004
H 1.375511 -4.323767 -2.190878
H 0.201179 -4.388515 -0.819224
H 3.354038 -2.316533 1.673402
H 1.849309 -1.363052 -1.584078
H 5.103006 1.848254 -0.462356
H 5.908154 1.182963 1.782856
H 3.816271 1.506063 -2.391566
H 3.521489 -0.178771 -2.809614
H 2.235361 0.802547 -2.066000


%chk=000276429-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000276429

0 1
Cl -0.634668 -0.363312 -3.925859
S 5.745525 -1.735433 3.459195
F 7.206965 -2.454262 2.561052
O 0.323658 -2.577732 -2.231645
O 2.301025 -4.034696 0.483247
O 6.340636 -0.575898 4.399709
O 4.932298 -2.987334 4.048831
N -4.204886 0.118998 -0.082758
N -5.164401 1.691181 1.580042
N -6.583526 0.160426 0.286654
N -5.670006 -1.404576 -1.177529
N -7.433323 1.377681 2.084516
N 2.409126 -1.951890 -0.631660
C -4.071578 1.497277 0.619058
C -2.739137 1.544501 1.390642
C -4.127483 2.608918 -0.466374
C -3.061213 -0.573962 -0.604604
C -5.498822 -0.344640 -0.309366
C -6.323282 1.104235 1.306566
C -2.494961 -0.199234 -1.854528
C -2.472663 -1.638935 0.121524
C -1.369443 -0.878844 -2.344484
C -1.345758 -2.323091 -0.379970
C -0.785146 -1.954159 -1.627527
C 3.336252 -1.219397 0.150896
C 3.603622 0.137858 -0.227907
C 0.958503 -3.705314 -1.530640
C 4.887094 -0.991401 1.972227
C 3.988176 -1.801765 1.268920
C 1.948414 -3.247633 -0.439171
C 4.526560 0.887145 0.536421
C 5.193490 0.338940 1.653708
C 2.904135 0.764048 -1.420003
H -1.864099 1.459409 0.722669
H -2.693431 2.510894 1.918504
H -2.705116 0.743080 2.147718
H -4.118305 3.593805 0.031697
H -3.261153 2.557337 -1.151784
H -5.061955 2.527513 -1.049772
H -2.938378 0.614935 -2.434141
H -2.901654 -1.921196 1.087577
H -0.904615 -3.128344 0.214584
H -6.615642 -1.766010 -1.274265
H -4.912135 -1.769213 -1.747492
H -7.355249 2.049711 2.842052
H -8.289395 0.858050 1.917038
H 1.512683 -4.241914 -2.319455
H 0.221870 -4.396375 -1.086842
H 3.777318 -2.835097 1.558710
H 1.999304 -1.473881 -1.442274
H 4.730720 1.924448 0.251382
H 5.902976 0.920647 2.248638
H 3.222118 1.809751 -1.555727
H 3.131316 0.230578 -2.364039
H 1.803032 0.771474 -1.298064


