%chk=000207030.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207030

0 1
S -3.266905 0.479607 0.860529
S -4.540443 -0.889637 0.060465
O 4.617129 -0.175260 -0.373610
O 3.190520 1.292412 -1.343634
N 1.177441 -0.111024 0.283714
N -1.684256 -0.017427 0.396589
N 2.412676 -0.665973 -0.219727
C 0.392827 -1.224205 0.938812
C 0.379164 0.448970 -0.870316
C -0.906862 -0.617863 1.512208
C -0.928161 1.048133 -0.314023
C 3.348463 0.298681 -0.673879
C -4.794049 -0.432353 -1.658110
H 0.992004 -1.652104 1.770369
H 0.146851 -2.052815 0.237241
H 0.160370 -0.310462 -1.651299
H 0.979361 1.257317 -1.355974
H -1.509274 -1.428333 1.982667
H -0.656214 0.118110 2.310164
H -0.690307 1.918136 0.340498
H -1.542426 1.429830 -1.160545
H 2.826783 -1.350541 0.442631
H -5.541800 -1.116599 -2.083963
H -3.873411 -0.530927 -2.246538
H -5.169595 0.591535 -1.767706
H 5.325714 0.355991 -0.826564


%chk=000207030-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207030

0 1
S -3.326962 -0.038068 0.994646
S -3.264931 -1.823812 -0.602002
O 3.892639 -0.994402 -1.477291
O 3.636828 0.757624 0.074779
N 0.826146 0.038113 0.111875
N -1.747154 0.652390 1.226055
N 1.825010 -0.590770 -0.661428
C 0.230704 -0.881674 1.120792
C -0.188817 0.727028 -0.730131
C -0.730642 -0.074321 2.025462
C -1.143103 1.524330 0.190716
C 3.139867 -0.168793 -0.600976
C -3.711312 -0.878042 -2.173875
H 1.050218 -1.298799 1.730221
H -0.325978 -1.720578 0.639859
H -0.778917 0.001759 -1.340821
H 0.338689 1.419160 -1.408285
H -1.245111 -0.741323 2.735028
H -0.147592 0.677754 2.590581
H -0.563880 2.312027 0.709435
H -1.947760 1.996107 -0.395771
H 1.596604 -1.382508 -1.278436
H -3.876820 -1.637625 -2.956848
H -2.892367 -0.207361 -2.478896
H -4.637311 -0.305281 -2.017576
H 4.837553 -0.699737 -1.437115


