%chk=000298553.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298553

0 1
O 2.240260 0.314827 0.000575
O -5.472898 -2.643208 -0.001155
O -3.370769 -3.128920 -0.001518
O -5.680013 3.510558 0.001334
O -7.071275 1.852374 0.000222
N -0.281112 -0.765194 0.000050
N -1.559356 -1.285570 -0.000393
N -4.301847 -2.317337 -0.001113
N -5.944277 2.319389 0.000708
C 4.315109 -0.719641 -0.000687
C 3.618794 0.517684 0.000302
C 3.298982 -1.752112 -0.001030
C 6.377790 0.527362 -0.000553
C 5.644331 1.760205 0.000494
C 5.718713 -0.698234 -0.001118
C 2.081735 -1.099110 -0.000274
C 4.250944 1.763523 0.000912
C 3.534919 -3.208117 -0.002191
C 7.873207 0.555014 -0.001028
C 6.375029 3.062929 0.001076
C 0.723840 -1.602521 -0.000223
C -2.625849 -0.402390 -0.000094
C -3.971055 -0.900387 -0.000469
C -2.424695 1.017110 0.000598
C -5.053059 0.008994 -0.000199
C -4.818241 1.375481 0.000441
C -3.485591 1.883417 0.000855
H 6.272744 -1.634755 -0.001914
H 3.670330 2.681619 0.001675
H 3.096921 -3.693981 0.883424
H 3.106080 -3.690683 -0.894135
H 4.609140 -3.449380 0.002908
H 8.263665 1.076753 -0.886697
H 8.264220 1.074071 0.885974
H 8.314853 -0.450084 -0.002702
H 7.019099 3.160867 -0.885543
H 5.700193 3.929736 0.003202
H 7.021830 3.158684 0.885934
H 0.657211 -2.707086 -0.000916
H -1.742169 -2.320667 -0.001031
H -1.394235 1.398175 0.000915
H -6.087897 -0.381224 -0.000492
H -3.337400 2.972231 0.001375


%chk=000298553-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298553

0 1
O 2.321340 0.506191 -0.000059
O -5.439842 -2.845426 -0.001053
O -3.184105 -3.170975 -0.003090
O -6.057706 3.403897 0.001915
O -7.388856 1.545108 0.001178
N -0.319619 -0.531197 -0.000637
N -1.565749 -1.131478 -0.000713
N -4.239212 -2.380642 -0.001611
N -6.230778 2.120448 0.001314
C 4.336861 -0.652206 -0.000693
C 3.722873 0.633149 -0.000079
C 3.267389 -1.629326 -0.001040
C 6.514016 0.466187 -0.000322
C 5.855355 1.752649 0.000328
C 5.754656 -0.721922 -0.000832
C 2.069725 -0.896334 -0.000659
C 4.442044 1.833352 0.000469
C 3.414584 -3.128828 -0.001864
C 8.030985 0.394320 -0.000348
C 6.676795 3.027906 0.000704
C 0.714758 -1.362832 -0.000833
C -2.702186 -0.352598 -0.000399
C -4.025051 -0.936055 -0.000561
C -2.602300 1.078350 0.000247
C -5.178534 -0.121139 0.000075
C -5.028566 1.269783 0.000748
C -3.740010 1.878804 0.000818
H 6.266151 -1.690976 -0.001345
H 3.930185 2.799771 0.000998
H 2.947064 -3.590052 0.887975
H 2.951652 -3.588544 -0.894898
H 4.479027 -3.415413 0.000614
H 8.464018 0.895576 -0.887157
H 8.463830 0.892398 0.888363
H 8.380669 -0.651662 -0.002152
H 7.334016 3.087969 -0.888015
H 6.030776 3.921359 0.003376
H 7.337690 3.085190 0.886839
H 0.595315 -2.461625 -0.001127
H -1.730949 -2.162254 -0.000608
H -1.599144 1.509142 0.000356
H -6.170793 -0.579221 -0.000071
H -3.670176 2.969558 0.001349


