%chk=000247423.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247423

0 1
S 4.739083 -1.209753 -1.049332
O 1.168864 -0.319007 2.262196
O 0.992239 1.866549 -2.031614
N -0.317624 1.471216 0.631881
N 2.658171 0.424250 -1.473627
N 2.764708 -0.655749 0.671335
C -1.564127 0.836027 0.282309
C -2.908615 -1.159041 -0.073040
C -4.076927 -0.365267 -0.110617
C -1.660081 -0.556465 0.122124
C -2.723684 1.632115 0.234263
C -3.963600 1.023240 0.043030
C 0.886580 0.846564 0.154647
C -2.988446 -2.642888 -0.241503
C -5.422576 -0.983641 -0.316578
C 1.408270 1.130853 -1.165033
C 1.575333 -0.007867 1.016412
C 3.248343 -0.418006 -0.547477
C 5.216451 -2.198539 0.371849
H -0.763677 -1.171673 0.140330
H -0.309815 2.478497 0.416249
H -2.662891 2.711485 0.343395
H -4.858777 1.644413 0.008754
H -2.007478 -3.130985 -0.177425
H -3.626783 -3.097314 0.529557
H -3.417593 -2.907542 -1.218744
H -5.654114 -1.708427 0.476344
H -6.230634 -0.241145 -0.319876
H -5.472306 -1.517144 -1.276333
H 3.068604 0.578211 -2.402330
H 0.309413 0.178690 2.491510
H 6.155005 -2.715174 0.130495
H 4.451012 -2.947162 0.629635
H 5.368871 -1.581323 1.271514


%chk=000247423-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247423

0 1
S 5.280444 -0.793509 -0.428809
O 0.562231 -0.920753 1.374639
O 1.722914 2.521685 -1.875636
N -0.308646 1.386501 -0.418208
N 3.264486 0.914253 -1.123025
N 2.658644 -0.783612 0.419174
C -1.569146 0.783054 -0.219540
C -3.035598 -1.215303 -0.137170
C -4.148463 -0.395950 0.213130
C -1.765012 -0.622961 -0.354131
C -2.686515 1.597879 0.107768
C -3.946378 1.005604 0.309324
C 0.955933 0.778088 -0.382846
C -3.199708 -2.715209 -0.302201
C -5.520949 -0.996553 0.457412
C 1.960504 1.474626 -1.188348
C 1.373500 -0.280590 0.449014
C 3.559822 -0.195863 -0.344754
C 5.169669 -2.190867 0.823518
H -0.954492 -1.247540 -0.747800
H -0.283726 2.328138 -0.828209
H -2.556367 2.680436 0.217884
H -4.798670 1.647104 0.563822
H -2.242486 -3.200628 -0.555644
H -3.581843 -3.184845 0.624442
H -3.926004 -2.956660 -1.102073
H -5.506114 -1.730595 1.286361
H -6.256882 -0.215737 0.714192
H -5.898386 -1.533795 -0.434310
H 3.983206 1.381327 -1.685381
H -0.403853 -0.693285 1.247067
H 6.176116 -2.635833 0.852536
H 4.418667 -2.919490 0.490454
H 4.884300 -1.781118 1.801647


