%chk=000201242.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201242

0 1
S 0.482057 -1.615237 -0.041804
O 1.691233 2.622349 -0.112425
N -2.332891 1.974314 -0.068506
C -0.556011 -0.215590 -0.052287
C -0.067612 1.069754 -0.075181
C -1.965851 -0.468830 -0.036018
C 2.401283 0.378127 -0.087835
C 2.113862 -0.986235 -0.065758
C 1.365748 1.448358 -0.093270
C -2.828694 0.668494 -0.045203
C -1.023446 2.156249 -0.082536
C -2.552545 -1.769985 -0.011468
C 3.754301 0.780539 -0.106277
C 3.130006 -1.951862 -0.061627
C -4.247467 0.490909 -0.030391
C -3.919521 -1.915761 0.002524
C 4.773824 -0.166880 -0.102605
C 4.460623 -1.534909 -0.080289
C -4.774200 -0.776581 -0.007107
H -0.640018 3.192021 -0.100591
H -1.915055 -2.655874 -0.003579
H 3.981924 1.852893 -0.123583
H 2.892618 -3.016342 -0.044186
H -4.879507 1.381861 -0.038161
H -4.370873 -2.907558 0.021286
H 5.815999 0.151127 -0.117102
H 5.262404 -2.274640 -0.077570
H -5.854193 -0.930109 0.004349


%chk=000201242-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000201242

0 1
S 0.481634 -1.736411 -0.043167
O 1.706052 2.663220 -0.115986
N -2.356785 1.989930 -0.068526
C -0.574916 -0.263925 -0.053778
C -0.069797 1.049863 -0.077153
C -2.004524 -0.484323 -0.036964
C 2.422192 0.371668 -0.088912
C 2.156280 -1.023244 -0.067104
C 1.370403 1.432686 -0.095520
C -2.857493 0.685710 -0.044875
C -1.028345 2.133255 -0.083617
C -2.613165 -1.779275 -0.012812
C 3.782488 0.795283 -0.105673
C 3.214875 -1.966577 -0.062597
C -4.275645 0.520722 -0.027992
C -4.005000 -1.913339 0.003377
C 4.836174 -0.130844 -0.101176
C 4.549019 -1.521004 -0.079597
C -4.843662 -0.756881 -0.004119
H -0.624923 3.151012 -0.102255
H -1.984919 -2.677194 -0.006786
H 3.961709 1.875178 -0.122193
H 2.992349 -3.039265 -0.045782
H -4.884784 1.429512 -0.034538
H -4.456290 -2.911044 0.021974
H 5.874530 0.215381 -0.114246
H 5.362866 -2.253899 -0.075967
H -5.932322 -0.875593 0.008783


