%chk=000195523.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195523

0 1
S 5.572450 -0.398574 0.107433
O 1.383070 2.123927 -1.094429
O 6.120808 0.776559 -0.614533
N -1.228893 -0.628967 -0.851604
N -1.257912 0.539274 1.134115
N -3.745238 0.608766 1.375506
N -6.210456 -0.782986 -1.018971
C 0.988733 -0.012896 0.135569
C -0.470940 0.012131 0.186835
C -2.576180 -0.478138 -0.511686
C 1.781727 0.980765 -0.462953
C -2.588354 0.262908 0.738120
C 1.634320 -1.120485 0.735154
C 3.779683 -0.267180 0.056105
C 3.196710 0.839368 -0.517470
C 3.015242 -1.254350 0.699221
C -3.772347 -0.883020 -1.116117
C -4.948499 -0.519069 -0.452489
C -4.880531 0.223788 0.788164
C 5.736817 -1.825707 -1.001895
C 0.058298 2.664782 -0.857705
H -0.863151 -1.099743 -1.658267
H 1.022356 -1.873872 1.236491
H 3.791893 1.621836 -1.005284
H 3.490446 -2.109461 1.174172
H -3.779253 -1.432818 -2.049569
H -5.808863 0.512848 1.295374
H 5.256985 -2.710313 -0.579516
H 6.798634 -2.048393 -1.156230
H 5.308731 -1.645815 -1.993717
H -6.998250 -0.799977 -0.387419
H -6.253182 -1.516359 -1.711385
H -0.151439 2.729829 0.217028
H -0.688784 2.069712 -1.387668
H 0.151567 3.666232 -1.299080


%chk=000195523-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000195523

0 1
S 5.437651 0.134532 0.397439
O 0.675039 1.433745 -1.417867
O 5.658713 1.370137 -0.716327
N -1.580251 0.270811 -0.575058
N -1.383428 -1.379293 1.004046
N -3.798478 -1.869015 1.198864
N -6.557311 -0.213270 -0.663675
C 0.743476 -0.326132 0.248556
C -0.711735 -0.487998 0.238160
C -2.875975 -0.155724 -0.316799
C 1.449629 0.617779 -0.565437
C -2.734112 -1.194192 0.679475
C 1.497164 -1.152471 1.127429
C 3.544716 -0.132055 0.372861
C 2.855737 0.716156 -0.502179
C 2.900698 -1.062676 1.207175
C -4.140221 0.216946 -0.806966
C -5.249655 -0.486380 -0.264196
C -5.013220 -1.509760 0.726892
C 5.883700 -1.454125 -0.602182
C 1.383337 2.424758 -2.242026
H -1.231252 0.989623 -1.213077
H 0.935275 -1.860363 1.744754
H 3.455648 1.423461 -1.091829
H 3.458001 -1.698300 1.903356
H -4.275905 1.000434 -1.560558
H -5.872870 -2.051693 1.144117
H 5.577886 -2.340231 -0.025757
H 6.972642 -1.419600 -0.751533
H 5.343006 -1.376030 -1.555886
H -7.336359 -0.725034 -0.260165
H -6.758131 0.501514 -1.356505
H 2.084273 1.929337 -2.938179
H 1.931479 3.144525 -1.607412
H 0.597032 2.945189 -2.808214


