%chk=000215787.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215787

0 1
O 1.724071 -2.292483 0.445266
O 1.983640 2.561521 -0.470715
O 3.376897 0.105242 0.378170
N -4.463138 -0.062682 -0.149365
C -5.442744 -0.561917 0.862232
C -4.938904 -1.477751 -0.232270
C -3.055167 0.167686 0.305742
C -2.183200 0.205002 -0.973311
C -3.007943 1.498135 1.062814
C -0.720088 0.179391 -0.635873
C 0.034678 1.352742 -0.688047
C -0.109563 -1.035971 -0.283220
C 1.250563 -1.059029 0.039810
C 1.404267 1.327953 -0.354253
C 2.024919 0.124097 0.041661
C 2.976356 -2.728817 -0.150441
C 3.416132 2.684213 -0.270384
C 3.589151 -0.032879 1.814441
H -6.440256 -0.118222 0.795915
H -5.150115 -0.731409 1.898588
H -4.281027 -2.312757 0.009265
H -5.569068 -1.703078 -1.097176
H -2.676173 -0.648031 0.976689
H -2.447170 1.101422 -1.573246
H -2.440704 -0.653468 -1.629468
H -3.558136 1.445527 2.007754
H -3.455433 2.310018 0.473694
H -1.973472 1.785148 1.287447
H -0.412484 2.300470 -0.981719
H -0.673985 -1.964276 -0.261260
H 2.784157 -3.008226 -1.190367
H 3.229122 -3.602428 0.459404
H 3.746511 -1.951097 -0.086845
H 3.955313 1.931841 -0.857190
H 3.643843 2.583275 0.793684
H 3.605952 3.700195 -0.634769
H 3.159790 0.823492 2.339629
H 4.680326 -0.047729 1.888704
H 3.147579 -0.970522 2.168613


%chk=000215787-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215787

0 1
O 1.847226 -2.256621 0.659735
O 2.108024 2.624177 -0.172433
O 3.410929 0.173164 0.677264
N -4.512508 0.046116 -0.169454
C -5.494942 -0.636615 0.748224
C -4.991906 -1.346141 -0.500820
C -3.108578 0.147139 0.342516
C -2.167609 0.224903 -0.893845
C -3.004495 1.384762 1.249456
C -0.691912 0.204292 -0.529047
C 0.084175 1.386175 -0.567429
C -0.065972 -1.008040 -0.142162
C 1.294276 -1.028296 0.223908
C 1.448396 1.380891 -0.191750
C 2.061123 0.171464 0.238437
C 2.992935 -2.749515 -0.139020
C 3.403417 2.707724 -0.882885
C 3.546308 -0.016821 2.142918
H -6.500172 -0.204406 0.771833
H -5.127545 -1.011976 1.714340
H -4.296775 -2.185121 -0.350278
H -5.630856 -1.427725 -1.385765
H -2.830355 -0.762746 0.934904
H -2.420516 1.144230 -1.453347
H -2.407273 -0.632133 -1.553770
H -3.684969 1.293832 2.115667
H -3.289078 2.290979 0.685095
H -1.974916 1.511407 1.626063
H -0.355762 2.338831 -0.879779
H -0.617557 -1.954327 -0.130590
H 2.669384 -2.960059 -1.176363
H 3.309000 -3.683328 0.350796
H 3.816643 -2.014053 -0.143011
H 3.254936 2.518740 -1.963802
H 4.128257 1.988294 -0.467544
H 3.746540 3.742314 -0.729116
H 3.053524 0.814563 2.679966
H 4.628785 -0.008513 2.343921
H 3.104314 -0.982961 2.446770


