%chk=000291248.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291248

0 1
S -1.802259 0.104833 -0.507861
S 1.325699 0.545069 1.056165
O -2.319600 -1.971864 1.717800
O -1.924682 -3.292432 -0.049859
O 1.697549 -2.748760 0.399914
N 0.207974 -1.559532 -0.879896
C -0.660025 -1.150587 0.222800
C 0.080126 -0.708106 1.471700
C -2.566092 0.940486 0.921018
C -1.653424 -2.285941 0.546122
C 2.884866 -0.208884 1.633241
C -3.673869 1.731810 0.308001
C 1.363304 -2.343668 -0.701022
C 3.918352 0.148444 0.618089
C -4.944356 1.157135 0.140809
C -3.449154 3.055492 -0.104009
C 2.116013 -2.626298 -1.966998
C 4.328198 1.482068 0.456372
C 4.493529 -0.855917 -0.177667
C -5.979112 1.903811 -0.427937
C -4.488840 3.796174 -0.671807
C -5.754383 3.223324 -0.833761
C 5.296445 1.803846 -0.498018
C 5.464438 -0.527349 -1.126355
C 5.866451 0.802098 -1.290494
H 0.570002 -1.593535 1.949660
H -0.610567 -0.308018 2.241200
H -0.029400 -1.212541 -1.812701
H -2.929867 0.191627 1.658514
H -1.824739 1.578550 1.441701
H 2.770600 -1.311581 1.742211
H 3.133154 0.187498 2.636455
H -5.123286 0.127710 0.447805
H -2.464111 3.505562 0.013961
H 3.890707 2.267736 1.070597
H 4.182934 -1.893626 -0.046513
H 2.680738 -1.740695 -2.301406
H 1.473487 -2.951705 -2.795835
H 2.850685 -3.430983 -1.797574
H -2.991222 -2.661840 1.967340
H -6.963005 1.455052 -0.557157
H -4.311236 4.822391 -0.990343
H -6.562506 3.802627 -1.276435
H 5.608853 2.839407 -0.623543
H 5.912897 -1.309528 -1.736241
H 6.622335 1.056343 -2.030142


%chk=000291248-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291248

0 1
S -2.008291 -0.491493 -0.623719
S 1.127731 0.239731 0.410285
O -2.340643 -2.191992 2.181276
O -2.243387 -3.845717 0.552884
O 1.925682 -2.978719 0.053765
N -0.218565 -2.523948 -0.812587
C -0.852733 -1.800431 0.284404
C 0.102915 -1.105068 1.263637
C -2.493850 0.724100 0.784965
C -1.857292 -2.739021 0.982350
C 2.802084 -0.105508 1.298303
C -3.444542 1.744533 0.205834
C 1.069584 -3.049259 -0.877229
C 3.915706 0.610103 0.575192
C -4.847634 1.536236 0.249683
C -2.943406 2.927770 -0.397331
C 1.395657 -3.709737 -2.215018
C 4.296658 1.927242 0.940445
C 4.598353 -0.028984 -0.493405
C -5.733237 2.495633 -0.288688
C -3.827829 3.887390 -0.937421
C -5.225282 3.674407 -0.883571
C 5.338520 2.592686 0.255848
C 5.641165 0.633309 -1.177370
C 6.013976 1.946950 -0.805588
H 0.814049 -1.843173 1.666512
H -0.482908 -0.664483 2.081864
H -0.850428 -2.783227 -1.574053
H -2.949776 0.121569 1.585427
H -1.556220 1.187992 1.130798
H 2.920439 -1.199859 1.253954
H 2.699091 0.235661 2.341179
H -5.242544 0.620324 0.705687
H -1.860005 3.090868 -0.441664
H 3.773907 2.429819 1.763578
H 4.307120 -1.047466 -0.777006
H 1.933221 -2.983600 -2.851890
H 0.502717 -4.056581 -2.763473
H 2.065581 -4.564703 -2.035264
H -3.008809 -2.818434 2.571315
H -6.814844 2.325910 -0.244832
H -3.429358 4.798362 -1.397591
H -5.911886 4.419535 -1.300789
H 5.623959 3.609176 0.549788
H 6.164998 0.127362 -1.996474
H 6.823959 2.460439 -1.336107


