%chk=000190681.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190681

0 1
S -1.018737 0.923951 -1.674794
O 0.732732 -1.583302 1.013290
O 2.816065 1.861185 -2.760102
O 1.099960 0.592263 -2.422183
O 0.734264 -3.301303 -0.511029
N -1.705588 -0.280072 0.558494
N 2.054998 1.258236 -2.024237
N 0.558123 -3.681446 1.806257
C 0.712497 -0.616193 -0.077065
C 1.663243 0.484308 0.353048
C -0.683632 -0.092719 -0.223871
C 2.291976 1.344308 -0.568597
C -2.677670 1.096613 -1.146097
C -2.867858 0.380129 0.066102
C 1.931600 0.653374 1.719377
C 3.183738 2.339892 -0.126185
C 2.812775 1.643316 2.157976
C -3.721114 1.794331 -1.745719
C -4.126396 0.362153 0.688175
C 3.442429 2.486777 1.234389
C -4.968152 1.770792 -1.118939
C -5.166440 1.063147 0.082612
C 0.640777 -2.933626 0.638056
C 0.140305 -5.097274 1.693941
H 1.044653 -1.137299 -1.025064
H 1.437494 -0.008451 2.440834
H 3.669136 2.992879 -0.861682
H 3.009489 1.760558 3.225686
H -3.571954 2.340122 -2.675805
H -4.269254 -0.188732 1.616263
H 4.132382 3.258555 1.577900
H -5.805551 2.306740 -1.564687
H -6.154089 1.065985 0.543218
H 0.304442 -3.202047 2.670580
H -0.952855 -5.222622 1.770391
H 0.628457 -5.676812 2.496721
H 0.464556 -5.523417 0.723543


%chk=000190681-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190681

0 1
S -2.368265 -1.077771 -1.124082
O 0.128614 -1.895513 0.754502
O 2.649221 2.283110 -2.308580
O 0.961557 0.762494 -2.313460
O 1.788468 -3.048216 -0.487810
N -1.368513 1.121679 0.069808
N 1.883950 1.435948 -1.706399
N 0.648287 -4.032404 1.323991
C 0.330909 -0.719270 -0.136613
C 1.349994 0.244028 0.479598
C -1.029956 -0.090438 -0.304829
C 2.072726 1.232127 -0.246199
C -3.432564 0.367304 -0.896306
C -2.708648 1.422605 -0.247021
C 1.600942 0.161005 1.869805
C 3.014026 2.083087 0.379451
C 2.527855 1.009419 2.509072
C -4.783149 0.522625 -1.265575
C -3.353602 2.650897 0.030469
C 3.242690 1.973594 1.761843
C -5.410648 1.755971 -0.980925
C -4.702757 2.809308 -0.339322
C 0.949012 -3.023524 0.444693
C 1.307566 -5.340765 1.263261
H 0.700836 -1.095750 -1.106631
H 1.052102 -0.588430 2.445639
H 3.542850 2.815231 -0.235754
H 2.690184 0.918946 3.588394
H -5.335607 -0.280530 -1.762304
H -2.791917 3.449883 0.523097
H 3.966386 2.633688 2.250126
H -6.459112 1.900826 -1.262811
H -5.214585 3.755046 -0.132824
H -0.091091 -3.856099 2.004826
H 0.581880 -6.145196 1.043208
H 1.823759 -5.571708 2.212855
H 2.053402 -5.308910 0.453603


