%chk=000187623.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187623

0 1
Cl -6.005832 0.233805 -2.047412
S -0.371522 -1.273379 0.118633
O -1.612516 1.800568 2.333686
O -0.502130 -1.934475 1.401447
O 0.345161 -1.951255 -0.951539
N 0.372377 0.247364 0.434280
C -0.148196 1.877840 2.259796
C 0.581794 0.605890 1.857827
C -1.012400 2.682869 1.331671
C 1.329090 0.895850 -0.512091
C 2.763332 0.417606 -0.313852
C 0.879569 0.719320 -1.963446
C -1.933621 -0.831089 -0.480408
C 3.708301 1.315777 0.206125
C 3.158646 -0.885498 -0.640503
C -2.826572 -0.127010 0.333129
C -2.301938 -1.210263 -1.777251
C 5.032559 0.912579 0.397222
C 4.483364 -1.287109 -0.446685
C 5.422512 -0.390619 0.072128
C -4.096673 0.209210 -0.148003
C -3.565541 -0.882995 -2.272906
C -4.443081 -0.176641 -1.443811
H 0.283653 2.371250 3.140565
H 0.224665 -0.224398 2.529361
H 1.669163 0.724452 2.086023
H -1.181204 3.741711 1.511814
H -1.174762 2.363336 0.303181
H 1.285069 1.999592 -0.273736
H 1.525298 1.301359 -2.633846
H -0.150139 1.056624 -2.120630
H 0.950112 -0.328344 -2.304631
H 3.417034 2.333442 0.458379
H 2.428179 -1.597771 -1.048035
H -2.537828 0.181047 1.353352
H -1.597931 -1.769264 -2.407749
H 5.761133 1.614017 0.799021
H 4.781302 -2.303550 -0.700932
H -4.799091 0.757371 0.480828
H -3.863605 -1.175377 -3.279430
H 6.453270 -0.705443 0.222226


%chk=000187623-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187623

0 1
Cl -6.209733 0.141427 -2.362061
S -0.448437 -1.330903 0.135543
O -1.556960 1.738580 2.497165
O -0.703516 -1.955693 1.621657
O 0.316293 -2.247654 -0.987817
N 0.314949 0.433663 0.450948
C -0.044944 1.750115 2.532354
C 0.678715 0.576592 1.878247
C -0.773642 2.806423 1.762307
C 1.335097 0.933946 -0.542270
C 2.783388 0.468144 -0.327258
C 0.851703 0.753660 -1.997847
C -2.109162 -0.849814 -0.607831
C 3.773197 1.427104 0.008856
C 3.167471 -0.891299 -0.471665
C -2.956473 -0.010959 0.137009
C -2.446466 -1.405962 -1.851850
C 5.122608 1.046221 0.192175
C 4.514000 -1.272560 -0.282871
C 5.496089 -0.308784 0.047739
C -4.222897 0.292600 -0.412259
C -3.715215 -1.098265 -2.393693
C -4.577622 -0.255510 -1.663243
H 0.349817 2.010940 3.525234
H 0.392349 -0.350231 2.419224
H 1.772562 0.707459 2.004374
H -0.872464 3.816237 2.177991
H -0.824749 2.711144 0.671243
H 1.318285 2.027206 -0.333430
H 1.505085 1.336027 -2.669889
H -0.183693 1.122589 -2.110294
H 0.893630 -0.301358 -2.313373
H 3.488470 2.482110 0.120533
H 2.414750 -1.646532 -0.728288
H -2.640414 0.414197 1.098551
H -1.742658 -2.060192 -2.375843
H 5.874686 1.800816 0.448625
H 4.797403 -2.325219 -0.394481
H -4.916676 0.942923 0.127437
H -4.023152 -1.509172 -3.358829
H 6.539327 -0.611618 0.191681


