%chk=000282248.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282248

0 1
O 4.967055 -0.767252 -0.427519
O -4.966746 -0.768370 0.427434
O 3.293308 -1.859990 0.686718
O -3.292708 -1.860666 -0.686798
O 3.253558 2.591373 -0.107356
O -3.254025 2.590676 0.107478
N 3.139478 0.444659 0.292867
N -3.139431 0.444002 -0.292843
N 3.808612 1.543570 -0.160267
N -3.808819 1.542733 0.160359
C 0.711149 0.449451 -0.285399
C -0.711101 0.449187 0.285420
C 1.744023 0.482250 0.848874
C -1.743983 0.481947 -0.848847
C 3.767207 -0.847838 0.225783
C -3.766860 -0.848645 -0.225837
C 5.698927 -2.026091 -0.524341
C -5.698320 -2.027387 0.524187
H 0.857544 1.322405 -0.954186
H 0.868721 -0.449905 -0.915608
H -0.868421 -0.450358 0.915424
H -0.857739 1.321947 0.954404
H 1.605217 -0.383601 1.537958
H 1.638017 1.410885 1.455004
H -1.638162 1.410688 -1.454847
H -1.605009 -0.383780 -1.538052
H 6.586623 -1.721173 -1.092397
H 5.098933 -2.765406 -1.064443
H 5.955770 -2.381854 0.478399
H -6.586098 -1.722706 1.092241
H -5.098161 -2.766585 1.064265
H -5.955060 -2.383164 -0.478575


%chk=000282248-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000282248

0 1
O 5.093980 -0.640034 -0.309020
O -5.093668 -0.641186 0.308999
O 3.218906 -1.945298 0.203596
O -3.218355 -1.945981 -0.203938
O 3.189637 2.638264 0.556956
O -3.190061 2.637637 -0.556574
N 3.143101 0.386164 0.435394
N -3.143082 0.385526 -0.435468
N 3.875731 1.608935 0.266414
N -3.875948 1.608117 -0.266217
C 0.725026 0.375919 -0.265742
C -0.725003 0.375711 0.265665
C 1.736861 0.363513 0.902955
C -1.736837 0.363257 -0.903033
C 3.794513 -0.834723 0.109105
C -3.794247 -0.835557 -0.109418
C 5.820914 -1.886240 -0.664526
C -5.820259 -1.887579 0.664549
H 0.897351 1.273139 -0.890496
H 0.893511 -0.516945 -0.897679
H -0.893281 -0.517293 0.897461
H -0.897534 1.272791 0.890564
H 1.603852 -0.543290 1.515267
H 1.601301 1.261389 1.532301
H -1.601476 1.261258 -1.532243
H -1.603630 -0.543424 -1.515480
H 6.816955 -1.539196 -0.969804
H 5.307018 -2.405216 -1.490520
H 5.880338 -2.555044 0.209920
H -6.816298 -1.540773 0.970103
H -5.306059 -2.406539 1.490363
H -5.879757 -2.556301 -0.209955


