%chk=000219868.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219868

0 1
S -4.092129 -1.427809 -0.288171
N 0.847098 -0.738943 -0.068347
N 0.528109 -2.086103 -0.103554
N -0.499012 1.393573 -0.090558
N -2.906722 0.975665 -0.204640
C -0.327388 0.029990 -0.103852
C -1.424702 -0.911655 -0.165276
C 2.225184 -0.314129 -0.015049
C -0.809835 -2.211771 -0.159978
C -2.716912 -0.355258 -0.213904
C -1.790348 1.811127 -0.143470
C 2.535982 1.028428 0.255994
C 3.245255 -1.260035 -0.234980
C 3.877010 1.418059 0.301013
C 4.576776 -0.847923 -0.181960
C -2.057627 3.276582 -0.134426
C 4.897458 0.488047 0.084153
C -5.527326 -0.343211 -0.337752
H -1.310406 -3.169634 -0.194111
H 1.750889 1.770596 0.426869
H 2.999448 -2.304254 -0.440878
H 4.123504 2.459342 0.508732
H 5.370933 -1.575162 -0.350536
H -1.128089 3.868104 -0.116821
H -2.634685 3.578095 -1.024149
H -2.657801 3.561983 0.745175
H 5.939016 0.801153 0.122166
H -6.426629 -0.970063 -0.385094
H -5.506898 0.320735 -1.213683
H -5.584552 0.298772 0.552785


%chk=000219868-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219868

0 1
S -4.155652 -1.499825 -0.362753
N 0.844638 -0.729870 -0.123733
N 0.570710 -2.112819 -0.213507
N -0.501781 1.360611 -0.051396
N -2.907830 0.942247 -0.166907
C -0.339162 0.004988 -0.125288
C -1.411095 -0.946426 -0.220784
C 2.212825 -0.298739 -0.050458
C -0.775859 -2.229727 -0.270690
C -2.723822 -0.396208 -0.239644
C -1.800877 1.769874 -0.074876
C 2.528979 1.080825 0.029699
C 3.238598 -1.276436 -0.061642
C 3.883474 1.470980 0.097701
C 4.585036 -0.865508 0.007362
C -2.079271 3.247946 0.008115
C 4.917129 0.507273 0.086999
C -5.559312 -0.246632 -0.350722
H -1.222340 -3.219473 -0.344436
H 1.725049 1.820266 0.037988
H 2.968188 -2.332506 -0.124353
H 4.128144 2.537132 0.159449
H 5.377010 -1.622339 -0.001484
H -1.135844 3.811051 0.057313
H -2.662539 3.578846 -0.869588
H -2.688598 3.473232 0.901893
H 5.965466 0.819964 0.140036
H -6.481345 -0.843492 -0.423088
H -5.454532 0.429915 -1.209549
H -5.529784 0.329151 0.584041


