%chk=000031585.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031585

0 1
 S   -1.493000     -0.9673000      9.9999997E-05
 S    1.493000     -0.9675000     -9.9999997E-05
 N   -5.126800      0.8282000      3.9999999E-04
 N    5.126800      0.8283000      8.9999998E-04
 C   -2.732200      0.3497000     -5.0000002E-04
 C    2.732200      0.3496000     -6.9999998E-04
 C   -4.135500     -0.2435000      1.4000000E-03
 C    4.135600     -0.2435000      1.0000000E-03
 C    0.000000      6.5899998E-02 -2.4000001E-03
 H   -2.583000      0.9745000      0.8871000    
 H   -2.586200      0.9733000     -0.8894000    
 H    2.584300      0.9723000     -0.8900000    
 H    2.584700      0.9752000      0.8865000    
 H   -4.293900     -0.8659000     -0.8864000    
 H   -4.292300     -0.8706000      0.8866000    
 H    4.292600     -0.8638000      0.8906000    
 H    4.293800     -0.8727000     -0.8825000    
 H   9.9999997E-05  0.6932000     -0.8981000    
 H   1.9999999E-04  0.6972000      0.8904000    
 H   -5.016300       1.398800      0.8377000    
 H   -6.060900      0.4239000      5.1800001E-02
 H    5.017600       1.396900     -0.8379000    
 H    6.061000      0.4239000     -4.8099998E-02


%chk=000031585-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000031585

0 1
S -0.891152 -0.699057 0.915722
S 1.914190 0.165672 2.009181
N -4.372915 0.538398 -0.979036
N 3.944656 0.212872 -1.613298
C -2.325996 0.434390 0.385786
C 2.340953 0.602005 0.210067
C -3.244787 -0.326979 -0.589204
C 3.620401 -0.140663 -0.218821
C 0.082880 0.540632 1.975063
H -2.883276 0.736007 1.290726
H -1.916432 1.332171 -0.106958
H 1.475440 0.279773 -0.398224
H 2.481480 1.690849 0.119280
H -2.670554 -0.579736 -1.499344
H -3.552481 -1.291801 -0.122573
H 4.463429 0.181618 0.420715
H 3.477282 -1.231491 -0.043050
H -0.089976 1.549587 1.566227
H -0.256054 0.490522 3.020529
H -5.088197 0.669772 -0.259665
H -4.767450 0.356816 -1.903950
H 3.327357 -0.201729 -2.316090
H 4.933003 0.146469 -1.864683


