%chk=000290755.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290755

0 1
S 2.289574 -1.541803 0.089858
O -2.468399 -0.496321 0.419736
O 1.165787 -3.342400 -1.101060
O 0.522757 -5.161176 0.054657
O -2.306094 -1.983580 2.159602
N -0.809812 -2.022530 0.357309
C 2.971083 0.060049 0.693446
C 1.826499 0.918663 1.143206
C 3.782710 0.562211 -0.468312
C 1.395336 -2.179763 1.546937
C 0.164421 -2.913504 1.019153
C 1.856267 1.489403 2.425379
C 4.849939 -0.227575 -0.934453
C 0.708796 1.131498 0.319104
C 3.527084 1.798692 -1.078387
C 0.598486 -3.962094 -0.017066
C 0.777461 2.253851 2.879912
C 5.631950 0.209178 -2.005433
C -0.370204 1.884828 0.783941
C 4.316366 2.232356 -2.148069
C -0.340336 2.448322 2.063673
C 5.366860 1.439329 -2.616729
C -1.887067 -1.542966 1.109004
C -3.732154 0.001738 0.987988
C -4.388216 0.741869 -0.140208
C -3.669105 1.711445 -0.853930
C -5.724470 0.476182 -0.472044
C -4.284112 2.414926 -1.891832
C -6.337876 1.189137 -1.506155
C -5.620245 2.157166 -2.216406
H 3.662522 -0.148004 1.550511
H 1.103474 -1.358900 2.232559
H 2.052056 -2.856711 2.125707
H -0.353206 -3.459543 1.869287
H 2.721438 1.345648 3.070429
H 5.072910 -1.186326 -0.465357
H 0.683939 0.709794 -0.687021
H 2.717335 2.434806 -0.720651
H -0.455356 -1.461767 -0.428815
H 0.808876 2.695931 3.874897
H 6.451921 -0.410829 -2.364859
H -1.252289 2.019948 0.145271
H 4.109216 3.193741 -2.615793
H -1.183068 3.036123 2.422113
H 5.977549 1.777149 -3.451457
H -4.317777 -0.856775 1.367501
H -3.454521 0.661424 1.831308
H 1.495969 -3.986166 -1.791183
H -2.619567 1.901233 -0.597815
H -6.286021 -0.283551 0.069512
H -3.723049 3.163716 -2.448692
H -7.376888 0.985746 -1.761717
H -6.100649 2.707780 -3.023452


%chk=000290755-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000290755

0 1
S 2.179976 -1.549853 -0.264541
O -2.690303 -1.159660 0.051596
O 0.243153 -4.375354 -1.366660
O 1.442187 -5.354005 0.369755
O -1.872051 -1.838054 2.162885
N -0.899378 -2.553238 0.153000
C 2.798371 0.078849 0.585579
C 1.655664 0.935363 1.112905
C 3.733777 0.752860 -0.418120
C 1.373627 -2.383055 1.236143
C 0.179231 -3.286872 0.807915
C 1.812118 1.583739 2.365295
C 5.033565 0.212104 -0.608884
C 0.454889 1.139210 0.385778
C 3.353791 1.894782 -1.165762
C 0.687731 -4.450895 -0.042295
C 0.799680 2.427880 2.874741
C 5.932003 0.796422 -1.525636
C -0.558528 1.982527 0.892190
C 4.253506 2.481252 -2.085559
C -0.388533 2.632241 2.137274
C 5.543488 1.935580 -2.270389
C -1.813028 -1.854993 0.904560
C -3.730962 -0.361936 0.738717
C -4.302845 0.646531 -0.238895
C -3.599926 1.044387 -1.401819
C -5.560877 1.237446 0.042601
C -4.144166 2.021869 -2.266007
C -6.100735 2.219922 -0.816424
C -5.392890 2.616799 -1.975203
H 3.404861 -0.280263 1.437193
H 0.984765 -1.591682 1.898441
H 2.126559 -2.990583 1.764684
H -0.219143 -3.722056 1.745147
H 2.733523 1.431689 2.941349
H 5.332163 -0.678106 -0.042095
H 0.315715 0.611101 -0.564359
H 2.363723 2.336819 -1.016858
H -0.918169 -2.492709 -0.865549
H 0.935836 2.917914 3.845306
H 6.931089 0.366835 -1.659876
H -1.480797 2.129782 0.318378
H 3.946786 3.366945 -2.653431
H -1.177324 3.282721 2.531328
H 6.239891 2.392929 -2.982172
H -4.514417 -1.045843 1.115393
H -3.266080 0.130969 1.614636
H 0.632648 -5.120885 -1.897942
H -2.643213 0.566840 -1.634328
H -6.121572 0.928377 0.934099
H -3.593839 2.316036 -3.166921
H -7.073887 2.668202 -0.586731
H -5.813552 3.374716 -2.645326


