%chk=000284733.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284733

0 1
S 0.002878 2.411276 -0.435831
S 5.138903 -3.166936 -2.527789
S -5.154497 -3.148119 -2.525489
O 0.003216 2.618203 -1.871873
O 0.005258 3.545017 0.479335
O 4.647888 -0.968740 0.842952
O -4.655915 -0.949433 0.843764
N 3.438324 -1.217605 -1.574588
N -3.446450 -1.204903 -1.573151
C 1.370852 1.417258 -0.029748
C -1.369130 1.422923 -0.029523
C 1.864433 0.501714 -0.962587
C -1.865994 0.508641 -0.961853
C 1.991245 1.573930 1.211931
C -1.989330 1.582951 1.211828
C 2.969604 -0.295026 -0.635279
C -2.974432 -0.283479 -0.634353
C 3.591346 -0.141868 0.648579
C -3.596027 -0.126904 0.649163
C 3.096651 0.796955 1.563541
C -3.097930 0.810622 1.563616
C 5.398025 -0.888765 2.110079
C -5.406245 -0.865498 2.110520
C 6.473468 -1.933574 1.912669
C -6.485826 -1.906096 1.913430
C 4.246183 -2.054941 -1.877346
C -4.257559 -2.039218 -1.875572
H 1.407176 0.407660 -1.957095
H -1.408766 0.412020 -1.956122
H 1.615630 2.324879 1.920141
H -1.610963 2.332914 1.919630
H 3.565233 0.934233 2.534120
H -3.566307 0.950471 2.533928
H 4.703724 -1.126974 2.933212
H 5.797402 0.135037 2.207100
H -5.801523 0.159979 2.206639
H -4.713248 -1.105913 2.934111
H 6.042826 -2.931924 1.741386
H 7.093802 -1.713904 1.029868
H 7.137006 -1.996297 2.783625
H -6.059155 -2.906305 1.743058
H -7.104904 -1.684567 1.030213
H -7.149970 -1.965494 2.784159


%chk=000284733-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000284733

0 1
S 0.002707 2.312839 -0.478115
S 5.460004 -3.040823 -2.912760
S -5.476003 -3.015979 -2.916370
O 0.003051 2.448820 -2.109729
O 0.005627 3.593288 0.544009
O 4.931974 -0.961145 0.829795
O -4.940341 -0.940250 0.830005
N 3.778857 -1.166655 -1.607009
N -3.788879 -1.149736 -1.607243
C 1.512413 1.269656 -0.023397
C -1.511643 1.276406 -0.023427
C 2.050902 0.426231 -1.004001
C -2.054003 0.435639 -1.004180
C 2.077122 1.440679 1.248292
C -2.075362 1.449504 1.248425
C 3.208462 -0.321297 -0.683969
C -3.214665 -0.307054 -0.684115
C 3.801177 -0.186772 0.621961
C -3.806429 -0.170478 0.622026
C 3.233287 0.697203 1.571016
C -3.234614 0.710865 1.571178
C 5.628729 -0.866228 2.137024
C -5.635951 -0.843139 2.137682
C 6.827266 -1.805721 2.060772
C -6.838002 -1.778168 2.061949
C 4.520213 -1.969858 -2.131364
C -4.533827 -1.949618 -2.131571
H 1.613000 0.366764 -2.005063
H -1.616569 0.374625 -2.005355
H 1.643363 2.158681 1.951495
H -1.638429 2.165453 1.951754
H 3.689398 0.818173 2.556942
H -3.690032 0.833552 2.557212
H 4.925631 -1.164014 2.940733
H 5.942324 0.184278 2.300478
H -5.945517 0.208492 2.301591
H -4.933493 -1.143742 2.940907
H 6.500573 -2.842880 1.877024
H 7.507278 -1.506137 1.246016
H 7.386484 -1.777144 3.013390
H -6.515248 -2.816492 1.877821
H -7.517402 -1.475934 1.247660
H -7.396532 -1.747685 3.014910


