%chk=000091050.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091050

0 1
 Cl  -8.324300      -2.271700      0.5466000    
 S   -1.680700      -1.086100     -0.9417000    
 S    7.648900     -0.7613000     -0.6957000    
 N    2.324000     -0.3998000     -0.9786000    
 N    5.037300     -0.4403000     -8.6700000E-02
 N    6.713300      8.1699997E-02   1.561800    
 C    3.387100     -0.9051000      -1.855600    
 C    2.640800     -0.7114000      0.4208000    
 C    4.734900     -0.2665000      -1.510700    
 C    3.962900     -6.5399997E-02  0.8412000    
 C    1.033000     -0.9762000      -1.352600    
 C  -7.0400000E-02 -0.3785000     -0.4884000    
 C    6.359100     -0.3336000      0.3601000    
 C   -2.706000     -0.1816000      0.2401000    
 C   -4.128800     -0.7098000      0.3177000    
 C   -2.637100       1.326200      6.2500000E-02
 C    8.770300     -0.3627000      0.5392000    
 C    8.090700      6.3600004E-02   1.661100    
 C   -4.756100     -0.7654000       1.546600    
 C   -4.754300      -1.120600     -0.8431000    
 C   -2.025700       2.087700       1.038900    
 C   -3.187200       1.892600      -1.070500    
 C   -6.061600      -1.251300       1.617900    
 C   -6.060000      -1.606500     -0.7720000    
 C   -1.962200       3.471500      0.8761000    
 C   -3.123500       3.276500      -1.233400    
 C   -6.713700      -1.671800      0.4586000    
 C   -2.510900       4.065900     -0.2601000    
 H    3.154500     -0.6686000      -2.901200    
 H    3.467900      -1.997900      -1.777700    
 H    2.693000      -1.797100      0.5779000    
 H    1.901900     -0.3095000       1.118100    
 H    5.472300     -0.7349000      -2.169600    
 H    4.715000      0.8050000      -1.748400    
 H    3.863300       1.027500      0.8603000    
 H    4.195600     -0.3959000       1.861100    
 H   0.8264000     -0.7439000      -2.405500    
 H    1.050900      -2.070200      -1.254300    
 H   5.1300000E-02 -0.6105000      0.5705000    
 H  -8.3400004E-02  0.7069000     -0.6235000    
 H   -2.253000     -0.4322000       1.209500    
 H    9.836600     -0.4564000      0.3915000    
 H    8.556700      0.3757000       2.585900    
 H   -4.258400     -0.4382000       2.454700    
 H   -4.291800      -1.064700      -1.822700    
 H   -1.593900       1.637000       1.927500    
 H   -3.658700       1.301400      -1.848000    
 H   -6.558800      -1.295900       2.583500    
 H   -6.557800      -1.925900      -1.684000    
 H   -1.484700       4.086200       1.633600    
 H   -3.548300       3.739300      -2.119400    
 H   -2.460500       5.143200     -0.3875000    


%chk=000091050-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000091050

0 1
Cl -8.680491 -2.271295 -0.040293
S -1.701247 -1.241326 -0.595540
S 7.806565 -0.281708 -1.210638
N 2.385581 -0.496892 -0.647774
N 5.186496 -0.145785 -0.145678
N 7.043988 -0.248204 1.374494
C 3.383317 -0.814845 -1.698703
C 2.950704 -0.788724 0.695419
C 4.655136 0.035130 -1.507179
C 4.207635 0.061386 0.945415
C 1.071385 -1.144077 -0.888418
C -0.064119 -0.384576 -0.177890
C 6.527985 -0.210048 0.147392
C -2.896899 -0.174951 0.482022
C -4.308640 -0.732243 0.319993
C -2.768720 1.311703 0.165260
C 9.047147 -0.383326 0.107457
C 8.440474 -0.349444 1.346632
C -5.178569 -0.718914 1.440381
C -4.802088 -1.229615 -0.912999
C -2.117395 2.166971 1.090271
C -3.279063 1.869718 -1.035784
C -6.509383 -1.180635 1.341579
C -6.128371 -1.701079 -1.030706
C -1.978431 3.549241 0.827068
C -3.139632 3.247998 -1.301951
C -6.964422 -1.665057 0.100582
C -2.489201 4.094472 -0.371709
H 2.947452 -0.583512 -2.687690
H 3.667781 -1.897591 -1.688226
H 3.211967 -1.872256 0.798482
H 2.201050 -0.544481 1.468717
H 5.414182 -0.271596 -2.247531
H 4.408476 1.103910 -1.679920
H 3.923421 1.133548 0.988811
H 4.695263 -0.213756 1.893589
H 0.877450 -1.125545 -1.977460
H 1.066470 -2.216847 -0.573375
H 0.055025 -0.401765 0.919757
H -0.103175 0.659398 -0.525687
H -2.566790 -0.342168 1.523184
H 10.101244 -0.456736 -0.147338
H 8.976718 -0.394677 2.295793
H -4.818886 -0.339084 2.403870
H -4.140451 -1.272904 -1.785212
H -1.720283 1.749577 2.024579
H -3.787530 1.225528 -1.760558
H -7.173664 -1.167371 2.210355
H -6.500278 -2.091061 -1.982630
H -1.474091 4.195314 1.554326
H -3.540549 3.665609 -2.232484
H -2.384645 5.165095 -0.579655


