%chk=000286637.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286637

0 1
S 0.789280 0.471537 0.216089
O 0.223909 0.153221 1.517089
O 0.715403 1.814299 -0.315396
O -2.571471 -0.007880 -1.976204
O -6.435564 1.391203 -0.016241
O -5.309328 0.462855 1.689695
N -0.035127 -0.563042 -0.906893
N -3.674251 -0.941382 -0.206159
C 2.414613 -0.084632 0.128919
C -1.226575 -1.275080 -0.408696
C 3.333059 0.568164 -0.703342
C 2.826106 -1.180295 0.895416
C 5.066806 -0.983482 -0.013814
C 4.651343 0.123078 -0.777777
C 4.144676 -1.631171 0.825883
C -2.516412 -0.644624 -0.939355
C 6.480356 -1.451752 -0.096255
C -4.957656 -0.344655 -0.611956
C -5.527546 0.505201 0.504035
H -0.198549 -0.193788 -1.861935
H -1.217103 -1.334419 0.710576
H -1.182229 -2.331824 -0.778229
H 3.017464 1.438648 -1.291369
H 2.116023 -1.682442 1.561350
H 5.361639 0.634285 -1.425242
H 4.457623 -2.483322 1.426244
H 7.173010 -0.692874 0.300336
H 6.662052 -2.376074 0.468694
H 6.782283 -1.647271 -1.136287
H -3.633110 -1.296436 0.749255
H -5.689557 -1.149590 -0.871607
H -4.828159 0.268856 -1.549157
H -6.845809 1.977790 0.677831


%chk=000286637-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000286637

0 1
S 0.874528 0.555143 0.053694
O 0.314287 0.428434 1.586279
O 0.879625 1.973915 -0.747738
O -2.473528 0.153487 -2.000217
O -7.185059 0.672284 0.032091
O -5.875087 -0.517060 1.544612
N -0.077487 -0.771514 -0.942580
N -3.690578 -0.399500 -0.103744
C 2.626211 -0.125330 0.017990
C -1.335300 -1.148863 -0.260197
C 3.507545 0.385590 -0.948066
C 2.992974 -1.088146 0.969032
C 5.251262 -1.098076 -0.027181
C 4.827204 -0.113979 -0.960523
C 4.320816 -1.570390 0.935258
C -2.544412 -0.400592 -0.857849
C 6.677870 -1.615603 -0.052061
C -4.907381 0.252433 -0.584454
C -6.001988 0.077799 0.450834
H -0.312737 -0.291254 -1.844695
H -1.229265 -0.952848 0.827138
H -1.476638 -2.238707 -0.396499
H 3.175471 1.160000 -1.646959
H 2.275637 -1.432260 1.720552
H 5.537175 0.267540 -1.703566
H 4.636175 -2.321302 1.668313
H 7.395789 -0.813455 0.203044
H 6.825073 -2.438626 0.667309
H 6.951608 -1.988394 -1.056107
H -3.724309 -0.803893 0.838054
H -5.237225 -0.172184 -1.551603
H -4.740935 1.331211 -0.769967
H -7.890122 0.557244 0.725301


