%chk=000284346.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284346

0 1
S 1.295871 0.322712 0.974214
O 4.851716 -0.292802 -0.756109
O 1.487637 1.556988 0.227400
O 1.638391 0.289408 2.382836
N 2.213648 -0.938512 0.212051
C 3.441089 -1.360215 0.943038
C 2.498353 -0.735970 -1.235778
C 4.635088 -0.431346 0.663839
C 3.693918 0.207294 -1.457197
C -0.325556 -0.210576 0.744964
C -1.253612 0.563911 0.178222
C -2.657352 0.163469 -0.020306
C -3.338110 0.603971 -1.169758
C -3.328772 -0.635154 0.919672
C -4.668168 0.235296 -1.379148
C -4.663354 -0.992724 0.708959
C -5.332805 -0.562006 -0.440299
H 3.684203 -2.397663 0.615935
H 3.229495 -1.407647 2.037489
H 1.594279 -0.352822 -1.753538
H 2.721664 -1.736617 -1.675410
H 4.502727 0.571627 1.107493
H 5.592049 -0.865391 1.004223
H 4.039259 0.216377 -2.504949
H 3.475463 1.239751 -1.118636
H -0.553091 -1.220994 1.098204
H -1.005098 1.574518 -0.190371
H -2.827358 1.228976 -1.901926
H -2.812307 -0.967857 1.820322
H -5.190666 0.572134 -2.273860
H -5.181706 -1.608772 1.443053
H -6.372095 -0.844465 -0.604330


%chk=000284346-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000284346

0 1
S 1.344525 0.496324 0.949377
O 4.961352 -0.457279 -0.812438
O 1.404730 1.770391 -0.086036
O 1.779784 0.666431 2.514878
N 2.313969 -1.046601 0.307171
C 3.571149 -1.231342 1.096687
C 2.554648 -0.941786 -1.167643
C 4.733192 -0.328762 0.637863
C 3.751805 -0.043622 -1.547465
C -0.387058 -0.193141 0.878557
C -1.290158 0.439950 0.091393
C -2.710953 0.092562 -0.075839
C -3.502497 0.897393 -0.942912
C -3.326551 -1.005379 0.591099
C -4.870822 0.616909 -1.138917
C -4.692376 -1.284276 0.394116
C -5.470371 -0.475253 -0.470973
H 3.838913 -2.297574 0.963263
H 3.338598 -1.056134 2.162381
H 1.630059 -0.592407 -1.662021
H 2.747980 -1.980893 -1.498777
H 4.518448 0.730464 0.897657
H 5.679675 -0.633243 1.114178
H 4.001930 -0.158847 -2.615124
H 3.514873 1.018471 -1.333028
H -0.497191 -1.056435 1.536882
H -0.920123 1.310529 -0.474268
H -3.038046 1.746282 -1.459033
H -2.738228 -1.639110 1.263856
H -5.467147 1.246920 -1.807412
H -5.156373 -2.130038 0.913095
H -6.532938 -0.695603 -0.620269


