%chk=000288504.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288504

0 1
S -4.055152 3.852345 -1.207775
O 4.105769 0.350349 3.263142
O 1.958138 0.410584 3.063901
O 6.206824 -0.508213 -2.459612
O 7.015919 -0.279697 -0.464873
N -0.252318 0.091466 -0.122500
N 0.809864 0.156942 0.763478
N 3.093861 0.302238 2.591369
N 6.089905 -0.343169 -1.256233
C -2.601814 0.146391 -0.655644
C -3.538478 -1.009088 -0.353488
C -3.267755 1.497116 -0.628965
C -1.460136 0.200156 0.346810
C -4.907486 -0.908028 -0.641080
C -3.028130 -2.211423 0.160110
C -4.054007 1.959141 0.500369
C -3.179970 2.417384 -1.633789
C 2.093733 0.037606 0.266089
C -5.757697 -1.990385 -0.398420
C -3.882881 -3.290083 0.402532
C -4.545833 3.215726 0.333878
C -5.249427 -3.182035 0.127044
C 3.218502 0.105834 1.154886
C 2.343904 -0.160066 -1.132490
C 4.527592 -0.020734 0.638354
C 4.728425 -0.211133 -0.720477
C 3.620040 -0.281018 -1.614861
H -2.191849 -0.040342 -1.692177
H -1.765675 0.342970 1.393810
H -5.316266 0.013853 -1.056503
H -1.964029 -2.319182 0.363866
H -4.222170 1.332368 1.366503
H -2.661240 2.335088 -2.573661
H -6.820444 -1.903370 -0.622008
H -3.480624 -4.219228 0.804723
H -5.154580 3.791926 1.010059
H 0.661717 0.311226 1.792990
H -5.913586 -4.023186 0.317226
H 1.485895 -0.211850 -1.813145
H 5.389653 0.033515 1.329287
H 3.817305 -0.432293 -2.685225


%chk=000288504-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000288504

0 1
S -4.056580 3.969808 -1.243949
O 4.107633 0.374440 3.331938
O 1.848388 0.417579 3.054125
O 6.338633 -0.482662 -2.470066
O 7.134285 -0.228251 -0.342424
N -0.236907 0.054846 -0.236372
N 0.815594 0.137570 0.675455
N 3.068879 0.310935 2.575947
N 6.169800 -0.306604 -1.198910
C -2.644501 0.127871 -0.675053
C -3.599531 -1.038997 -0.345002
C -3.303586 1.506286 -0.620886
C -1.447298 0.153433 0.257046
C -4.992097 -0.936321 -0.589230
C -3.081591 -2.266603 0.142096
C -4.019901 2.018727 0.533537
C -3.235357 2.429757 -1.652708
C 2.114696 0.032483 0.231359
C -5.847023 -2.034494 -0.347018
C -3.936158 -3.363934 0.389715
C -4.485221 3.309993 0.370638
C -5.323875 -3.251871 0.146216
C 3.239120 0.112735 1.136023
C 2.396772 -0.162846 -1.161559
C 4.565377 0.001594 0.663992
C 4.786387 -0.189212 -0.703992
C 3.704277 -0.272144 -1.625398
H -2.248494 -0.027193 -1.697738
H -1.650865 0.283812 1.337309
H -5.408163 0.002952 -0.969357
H -2.004236 -2.371531 0.318318
H -4.196251 1.434124 1.440675
H -2.760032 2.326401 -2.627276
H -6.920779 -1.939646 -0.543727
H -3.519543 -4.304373 0.767374
H -5.050715 3.930723 1.062781
H 0.693259 0.280918 1.699770
H -5.988321 -4.101868 0.336386
H 1.545379 -0.222291 -1.841551
H 5.401458 0.064688 1.365049
H 3.922586 -0.421133 -2.686034


