%chk=000277881.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277881

0 1
S 1.782468 -2.519134 -1.078624
O 1.776556 -2.330559 -2.510774
O 2.298308 -3.766078 -0.544097
O -4.345120 0.138786 1.531662
O -2.477288 -0.228956 2.562084
N -0.574035 -1.416576 -1.014054
N 0.118222 -2.549284 -0.516710
N -3.217823 -0.311510 1.600153
C -1.229498 -0.649333 0.093222
C -2.709527 -1.061972 0.360821
C -1.173470 0.822874 -0.280665
C -2.883285 -2.549775 0.632182
C -1.538003 1.275372 -1.556083
C -0.751640 1.745234 0.689538
C 2.482830 -1.180618 -0.271480
C -1.475522 2.639333 -1.858535
C -0.695446 3.106987 0.384023
C -1.055819 3.556489 -0.890709
C 3.334981 -1.398157 0.820558
C 2.212686 0.125784 -0.694649
C 3.645182 0.996389 1.059627
C 3.915344 -0.319446 1.482596
C 2.788979 1.211133 -0.032272
C 4.272215 2.145774 1.774241
H -0.642706 -0.820527 1.045904
H -3.361011 -0.747312 -0.498211
H -1.264060 -1.668039 -1.741644
H -2.171109 -2.915893 1.389249
H -2.734274 -3.145610 -0.276360
H -3.895276 -2.788912 0.993159
H -0.387578 -3.446883 -0.547976
H -1.861184 0.573498 -2.322299
H -0.476173 1.401487 1.688531
H -1.756922 2.986423 -2.852026
H -0.374911 3.819431 1.143081
H 3.547725 -2.422314 1.152288
H 1.542598 0.303201 -1.545080
H -1.013224 4.618402 -1.127259
H 4.578630 -0.493061 2.327813
H 2.568130 2.223704 -0.365741
H 3.949726 3.121568 1.386760
H 4.032930 2.131389 2.848348
H 5.369694 2.114891 1.690806


%chk=000277881-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000277881

0 1
S 2.035747 -0.995837 -1.411161
O 1.363073 0.457175 -1.847427
O 3.088171 -1.766051 -2.420252
O -3.938926 0.567710 1.884321
O -1.797198 1.347543 2.003487
N -0.930274 -1.165836 -1.375543
N 0.005804 -2.055855 -0.977321
N -2.687638 0.513548 1.596120
C -1.385822 -0.080909 -0.455331
C -2.200056 -0.673894 0.737069
C -2.149719 0.937633 -1.311889
C -1.410244 -1.608084 1.670407
C -3.563651 0.944357 -1.421628
C -1.390553 1.871997 -2.065476
C 2.978784 -0.683528 0.196771
C -4.208504 1.882297 -2.259299
C -2.038385 2.805499 -2.902614
C -3.449388 2.815562 -3.000362
C 4.129523 -1.452818 0.440713
C 2.510768 0.293754 1.088438
C 4.399588 -0.251090 2.579885
C 4.836184 -1.224438 1.640876
C 3.234675 0.504081 2.284180
C 5.177290 -0.017418 3.862437
H -0.485846 0.408327 -0.037313
H -3.123772 -1.161975 0.387115
H -1.095681 -0.956119 -2.372514
H -0.530219 -1.089520 2.087227
H -1.050895 -2.478779 1.101618
H -2.054580 -1.951072 2.498700
H 0.161318 -2.744424 -1.750267
H -4.179941 0.239620 -0.853749
H -0.296239 1.843352 -2.002460
H -5.301759 1.886027 -2.327326
H -1.441918 3.522847 -3.476496
H 4.468415 -2.183389 -0.301327
H 1.630842 0.900878 0.850146
H -3.952179 3.543957 -3.646213
H 5.740198 -1.808893 1.849731
H 2.889667 1.267656 2.990509
H 4.678347 0.721393 4.511740
H 5.291603 -0.953940 4.439040
H 6.195689 0.356857 3.646837


