%chk=000225351.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225351

0 1
S 3.482628 -0.353375 -0.299005
N -1.566948 0.337621 -0.036133
N 0.446319 1.285527 -0.619848
N -0.717257 -1.898125 0.714755
N 1.715270 -2.064241 0.530617
C -0.587982 -0.627779 0.213263
C -3.026957 0.162716 0.106308
C 0.677858 -0.015497 -0.148450
C -0.880456 1.473662 -0.557075
C -3.684885 -0.120238 -1.239545
C 1.831747 -0.810612 0.039935
C 0.461831 -2.551968 0.845412
C 3.399403 1.324947 -0.932973
H -3.211228 -0.684681 0.814465
H -3.451556 1.080974 0.572954
H -1.404883 2.374681 -0.846693
H -3.530471 0.691448 -1.960386
H -4.767522 -0.258938 -1.124229
H -3.288929 -1.038785 -1.697311
H 0.431887 -3.580490 1.242608
H 2.961725 2.027127 -0.208657
H 2.796974 1.399116 -1.849890
H 4.424432 1.645910 -1.158720


%chk=000225351-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225351

0 1
S 3.521298 -0.416243 -0.330973
N -1.566055 0.444029 -0.065072
N 0.472545 1.383601 -0.566367
N -0.840105 -1.835762 0.545059
N 1.587940 -2.108222 0.380608
C -0.616047 -0.559785 0.133243
C -3.026326 0.287481 0.090094
C 0.654583 0.037087 -0.178980
C -0.855816 1.575408 -0.486663
C -3.675952 -0.393582 -1.131276
C 1.781867 -0.818743 -0.032954
C 0.322232 -2.548479 0.645442
C 3.502592 1.389734 -0.877542
H -3.197818 -0.317922 0.997150
H -3.454917 1.291244 0.260722
H -1.357546 2.513897 -0.715434
H -3.511990 0.193253 -2.052021
H -4.764542 -0.490660 -0.970731
H -3.257008 -1.403454 -1.275875
H 0.233003 -3.587974 0.972772
H 3.080677 2.025390 -0.088939
H 2.915775 1.506914 -1.797322
H 4.562611 1.631787 -1.053538