%chk=000297960.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297960

0 1
Cl 3.766303 -4.586387 -0.475640
Cl -7.061415 -1.001265 -0.504825
S 3.013152 1.561386 0.152829
S -1.290637 0.605859 1.166591
O 2.760290 1.908017 1.534746
O 4.099407 2.182711 -0.569925
O -1.320912 1.486494 2.308093
O -0.476639 -0.603700 1.206387
N 1.554555 1.986386 -0.673613
N -0.750348 1.562569 -0.168815
C 0.383607 2.513928 0.079011
C 1.028986 1.183419 -1.807504
C -0.443074 0.839493 -1.441948
C 3.183268 -0.152710 -0.026248
C -2.894171 0.164452 0.691579
C 4.170787 -0.645552 -0.891742
C -3.192009 -1.177470 0.426015
C 2.393422 -1.035131 0.716223
C -3.888993 1.143688 0.598833
C 4.357980 -2.019804 -1.039327
C -4.485372 -1.548805 0.052872
C 2.567674 -2.417948 0.580046
C -5.188945 0.789243 0.225571
C 3.546286 -2.885031 -0.296332
C -5.464287 -0.554264 -0.042333
H 0.599676 2.665172 1.167492
H 0.093481 3.499648 -0.367552
H 1.627073 0.271908 -2.001666
H 1.069657 1.808390 -2.728357
H -1.140586 1.214150 -2.222340
H -0.588958 -0.255900 -1.355213
H 4.806751 0.053320 -1.452528
H -2.409970 -1.943132 0.515766
H 1.618693 -0.665609 1.409967
H -3.658932 2.192228 0.820327
H 5.123272 -2.411525 -1.708794
H -4.729014 -2.591341 -0.154424
H 1.945828 -3.107482 1.153315
H -5.972087 1.544694 0.150162


%chk=000297960-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297960

0 1
Cl 4.500374 -4.633149 -0.640552
Cl -7.570325 -0.622216 -0.072387
S 2.834873 1.533708 0.353440
S -1.337552 0.589759 1.056596
O 2.088184 1.652496 1.799849
O 4.177741 2.378079 0.026196
O -1.254450 1.732988 2.208503
O -0.617873 -0.879453 1.211749
N 1.509993 2.161344 -0.981174
N -0.801071 1.471164 -0.612480
C 0.235862 2.537904 -0.331696
C 1.153788 1.143594 -2.017483
C -0.170746 0.469140 -1.549386
C 3.262855 -0.284439 0.021852
C -3.150103 0.241673 0.701953
C 4.448850 -0.534898 -0.692031
C -3.514382 -1.061038 0.325993
C 2.439882 -1.290918 0.555975
C -4.068690 1.291472 0.867891
C 4.829536 -1.879611 -0.895804
C -4.881545 -1.326213 0.086729
C 2.828785 -2.634637 0.347475
C -5.434303 1.022401 0.628108
C 4.008946 -2.903582 -0.376498
C -5.813981 -0.279014 0.236118
H 0.354547 2.716670 0.759147
H -0.120316 3.469404 -0.810858
H 1.976349 0.425780 -2.173699
H 1.002836 1.695768 -2.963393
H -0.857728 0.278283 -2.390115
H 0.024216 -0.486529 -1.020315
H 5.067199 0.296028 -1.047008
H -2.758880 -1.849016 0.248759
H 1.526892 -1.058006 1.118636
H -3.736722 2.281896 1.193338
H 5.746326 -2.123003 -1.439568
H -5.212151 -2.327071 -0.203261
H 2.221852 -3.450632 0.749057
H -6.185270 1.807971 0.747040


