%chk=000171043.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000171043

0 1
 S   -1.612300      -1.122600       2.009100    
 S   -1.471400       1.022600      -1.845300    
 N    4.448100      6.8200000E-02 -0.1052000    
 C    3.050000     -2.4400000E-02  5.5100001E-02
 C    5.173000       1.208700      0.4187000    
 C    5.180200     -0.9827000     -0.7838000    
 C    2.355800      0.9857000      0.7214000    
 C    2.361000      -1.125900     -0.4528000    
 C   0.3063000     -0.2058000      0.3696000    
 C   0.9731000      0.8942000      0.8801000    
 C   0.9781000      -1.217300     -0.2942000    
 C    5.082800       2.396800     -0.5239000    
 C    5.460800      -2.147600      0.1504000    
 C   -1.157600     -0.3026000      0.5375000    
 C   -2.018500      0.2106000     -0.3888000    
 C   -3.464600      0.1321000     -0.2541000    
 C   -4.160600       1.150300      0.3978000    
 C   -4.155800     -0.9612000     -0.7766000    
 C   -5.547400       1.075100      0.5273000    
 C   -5.542600      -1.036200     -0.6471000    
 C   -6.238300     -1.7999999E-02  4.9000001E-03
 H    4.862000       1.474900       1.435400    
 H    6.234700      0.9495000      0.5266000    
 H    4.688000      -1.313000      -1.705500    
 H    6.147000     -0.5909000      -1.127100    
 H    2.830400       1.866100       1.139900    
 H    2.839400      -1.943500     -0.9800000    
 H   0.4434000       1.687600       1.400800    
 H   0.4524000      -2.080100     -0.6948000    
 H    5.483600       2.140800      -1.510800    
 H    4.056100       2.744600     -0.6677000    
 H    5.668100       3.234100     -0.1306000    
 H    6.033500      -1.816600       1.023700    
 H    4.546500      -2.621800      0.5181000    
 H    6.049400      -2.911600     -0.3675000    
 H   -3.637400       2.009200      0.8115000    
 H   -3.628800      -1.764000      -1.287000    
 H  -0.3924000      -1.391800       2.498300    
 H   -6.089200       1.867600       1.035100    
 H   -6.080800      -1.887500      -1.053600    
 H   -7.318100     -7.6700002E-02  0.1058000    
 H   -2.663800       1.319100      -2.383900    


%chk=000171043-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000171043

0 1
S -1.808143 -2.100034 1.015709
S -1.570222 1.959804 -1.041529
N 4.527422 0.057370 -0.067148
C 3.136679 -0.081876 0.013296
C 5.211525 1.276683 0.406778
C 5.376940 -0.995590 -0.657513
C 2.299463 0.984985 0.474368
C 2.482708 -1.304342 -0.355046
C 0.254345 -0.365285 0.154833
C 0.903959 0.839545 0.543451
C 1.087668 -1.434803 -0.278877
C 5.268047 2.407754 -0.647927
C 5.805347 -2.088651 0.350645
C -1.216850 -0.515534 0.221579
C -2.154688 0.389089 -0.221198
C -3.631575 0.254212 -0.119894
C -4.426472 1.334940 0.358046
C -4.289185 -0.941372 -0.523922
C -5.827927 1.212371 0.456722
C -5.693443 -1.059992 -0.430010
C -6.469245 0.013305 0.063190
H 4.722616 1.640569 1.329777
H 6.241042 0.994116 0.697627
H 4.854276 -1.453954 -1.517908
H 6.279132 -0.508187 -1.073471
H 2.734818 1.941782 0.775555
H 3.066238 -2.164741 -0.694606
H 0.307950 1.675012 0.927187
H 0.622934 -2.380649 -0.578889
H 5.801795 2.071214 -1.555256
H 4.253450 2.720308 -0.949786
H 5.799066 3.289898 -0.243827
H 6.378429 -1.648292 1.186719
H 4.926217 -2.601793 0.777672
H 6.443965 -2.844621 -0.143573
H -3.930981 2.260644 0.670087
H -3.702758 -1.768449 -0.938265
H -0.714757 -2.219815 1.861300
H -6.420202 2.049904 0.842643
H -6.180085 -1.988068 -0.750370
H -7.558714 -0.079871 0.134946
H -2.666681 2.068415 -1.886313


