%chk=000155635.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155635

0 1
 S  -0.1047000       2.782900     -0.3407000    
 O  -8.9699998E-02  -2.283200      0.1821000    
 N   -1.823400      0.6892000      4.6000001E-03
 N   -1.784600     -0.6959000     -1.4300000E-02
 N   0.3425000      4.1200001E-02 -2.8200001E-02
 C   -3.077400       1.335300     -0.3596000    
 C   -2.947700      -1.443700      0.4086000    
 C   -4.299800      0.6316000      0.2143000    
 C   -4.246200     -0.8533000     -0.1162000    
 C  -0.5004000       1.174700     -8.5699998E-02
 C  -0.4514000      -1.121900      3.2099999E-02
 C    1.768000     -1.0000000E-03 -5.5000000E-03
 C    2.443500      -1.102600     -0.5335000    
 C    2.490700       1.058600      0.5453000    
 C    3.837500      -1.144200     -0.5110000    
 C    3.884800       1.016800      0.5678000    
 C    4.558200     -8.4600002E-02  3.9700001E-02
 H   -3.123200       1.357400      -1.455300    
 H   -3.055700       2.375700     -1.9700000E-02
 H   -2.942800      -1.459700       1.505200    
 H   -2.832300      -2.481600      7.7399999E-02
 H   -5.214700       1.078300     -0.1893000    
 H   -4.324100      0.7631000       1.303100    
 H   -5.103000      -1.373600      0.3249000    
 H   -4.303400     -0.9890000      -1.203200    
 H    1.925800      -1.928000      -1.011300    
 H    2.024000       1.892200       1.054600    
 H    4.362700      -1.997500     -0.9302000    
 H    4.446200       1.831700       1.015700    
 H    5.643600     -0.1184000      5.9799999E-02


%chk=000155635-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000155635

0 1
S -0.098998 2.776881 -0.465511
O -0.078367 -2.367111 0.305437
N -1.812937 0.675343 -0.011458
N -1.794492 -0.751542 0.025322
N 0.314025 0.012164 -0.008787
C -3.039641 1.341312 -0.483594
C -2.970110 -1.468340 0.547332
C -4.274881 0.671530 0.154196
C -4.250164 -0.861775 -0.062869
C -0.516027 1.156512 -0.140371
C -0.469246 -1.188125 0.122941
C 1.753611 0.000918 0.000651
C 2.440750 -1.012241 -0.709374
C 2.468186 0.980861 0.728986
C 3.851373 -1.040176 -0.687815
C 3.878982 0.948912 0.733165
C 4.575636 -0.059306 0.027781
H -3.087503 1.279581 -1.590680
H -2.945284 2.404225 -0.208772
H -2.997555 -1.390527 1.654540
H -2.837052 -2.529475 0.281010
H -5.183473 1.111525 -0.293759
H -4.297765 0.895113 1.238286
H -5.129989 -1.334474 0.408635
H -4.287645 -1.089221 -1.145485
H 1.879176 -1.774826 -1.255069
H 1.927017 1.760600 1.270277
H 4.382417 -1.827402 -1.233526
H 4.432108 1.711135 1.292293
H 5.670848 -0.081573 0.037718


