%chk=000295672.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295672

0 1
S 0.524612 -4.103451 -0.128906
O -3.679621 0.882488 0.089259
O -1.860541 2.215965 0.138755
N 0.575692 0.973084 -0.016203
N 0.510325 -1.418367 -0.084927
N -1.628036 -2.591748 -0.054466
C -0.150199 -0.194332 -0.032436
C -1.586914 -0.166214 0.012817
C 2.009037 1.105028 -0.034190
C 2.543342 2.223519 0.639056
C 2.848617 0.218658 -0.725150
C -2.268167 -1.410094 -0.006905
C -2.324299 1.084984 0.084027
C -0.247310 -2.534986 -0.086650
C 3.920804 2.438581 0.617021
C 4.226788 0.451762 -0.730978
C -4.524292 2.089811 0.162253
C 4.766166 1.555223 -0.064768
C -5.931746 1.537369 0.145113
C 2.283995 -3.730672 -0.161492
H 0.036459 1.866562 0.075168
H 1.893545 2.912524 1.176545
H 2.437882 -0.645300 -1.250163
H -3.370730 -1.433848 0.019594
H 4.339912 3.300091 1.136793
H 4.883298 -0.234593 -1.265415
H -4.264772 2.620814 1.094172
H -4.281245 2.718732 -0.711441
H 5.840108 1.729139 -0.075895
H -6.674283 2.343266 0.195333
H -6.125710 0.956161 -0.767414
H -6.109957 0.860909 0.992864
H 2.571307 -3.004318 0.614420
H 2.596270 -3.314323 -1.127556
H 2.830665 -4.665726 0.017268


%chk=000295672-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000295672

0 1
S 0.477168 -4.293837 -0.450991
O -3.677585 0.856695 0.144763
O -1.735315 2.136746 0.228688
N 0.600104 0.814302 0.049319
N 0.496778 -1.562945 -0.180636
N -1.661241 -2.716339 -0.246918
C -0.128643 -0.344102 -0.047630
C -1.581940 -0.279040 -0.009889
C 2.000115 1.055314 0.039320
C 2.397005 2.418526 0.151083
C 2.994050 0.046411 -0.071822
C -2.274238 -1.512439 -0.115449
C -2.297102 0.995582 0.129394
C -0.286729 -2.662366 -0.271830
C 3.761356 2.766054 0.150493
C 4.357794 0.411365 -0.070423
C -4.469494 2.120288 0.283892
C 4.754087 1.763556 0.039423
C -5.939483 1.717180 0.261976
C 2.300757 -3.844277 -0.455170
H -0.011611 1.651420 0.143897
H 1.631835 3.200027 0.237394
H 2.681779 -0.993695 -0.156903
H -3.367479 -1.518747 -0.092904
H 4.049543 3.819454 0.236790
H 5.117958 -0.373664 -0.156447
H -4.174900 2.608637 1.230077
H -4.197923 2.790990 -0.550860
H 5.815429 2.033432 0.038986
H -6.572282 2.617242 0.366270
H -6.199121 1.218796 -0.687407
H -6.173767 1.030518 1.093090
H 2.569466 -3.362935 0.496017
H 2.517324 -3.172731 -1.298213
H 2.837307 -4.798720 -0.571876


