%chk=000267481.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267481

0 1
O 2.283318 -1.095660 1.690188
O 0.899650 -0.573151 -1.534619
O -8.415870 1.044502 0.465377
O -7.995136 0.916155 -1.724212
N 0.100340 -0.340969 0.635850
N -1.185850 -0.148256 0.222261
C 2.515928 -0.764487 0.300300
C 3.224713 0.579052 0.278654
C 3.363516 -1.849287 -0.337747
C 1.100927 -0.568129 -0.344708
C 3.437583 1.220222 -0.951058
C 4.518565 -2.250368 0.359101
C 3.673264 1.166513 1.467601
C 3.061289 -2.438523 -1.569165
C 4.099085 2.449377 -0.984864
C 5.343684 -3.246189 -0.162471
C 4.334529 2.397644 1.426158
C 3.893024 -3.436986 -2.089720
C 4.548220 3.039029 0.202389
C 5.029793 -3.844876 -1.388991
C -3.501071 0.301688 0.646767
C -2.111342 0.105653 1.109380
C -4.507922 0.482841 1.614753
C -3.835536 0.313774 -0.718858
C -6.159775 0.683281 -0.144144
C -5.831103 0.672474 1.220695
C -5.158828 0.503454 -1.113516
C -7.549249 0.881414 -0.599330
H 3.081469 0.760593 -1.876580
H 4.772454 -1.768631 1.305190
H 3.503767 0.660490 2.420081
H 2.182702 -2.122409 -2.143606
H 2.296197 -2.072089 1.819732
H 4.264009 2.949353 -1.938516
H 6.236085 -3.553471 0.380873
H 4.683286 2.856083 2.350071
H 3.649058 -3.892819 -3.049069
H 0.375562 -0.297993 1.634206
H 5.063517 3.997875 0.172093
H 5.674550 -4.622392 -1.796513
H -1.960586 0.191207 2.195685
H -4.259282 0.475212 2.674840
H -3.053072 0.172790 -1.471677
H -6.618990 0.813586 1.966244
H -5.425519 0.513690 -2.174935
H -9.354354 1.178734 0.164314


%chk=000267481-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267481

0 1
O 2.218453 -1.053877 1.700795
O 1.110481 -0.182331 -1.673884
O -8.518206 0.945949 0.564345
O -8.012613 1.336264 -1.668642
N 0.100392 -0.409745 0.442773
N -1.175081 -0.121286 0.007039
C 2.542697 -0.655178 0.291406
C 3.310086 0.682766 0.314341
C 3.342073 -1.798527 -0.353556
C 1.180436 -0.401041 -0.439036
C 3.782431 1.238759 -0.902238
C 4.716580 -1.931384 -0.019037
C 3.528000 1.374068 1.528781
C 2.735529 -2.779765 -1.177337
C 4.472325 2.469413 -0.897139
C 5.467198 -3.029364 -0.490464
C 4.222483 2.606098 1.530271
C 3.490152 -3.875017 -1.653048
C 4.697326 3.157302 0.319158
C 4.855006 -4.006523 -1.309447
C -3.520976 0.151833 0.537280
C -2.134780 -0.146662 0.911185
C -4.535205 0.105312 1.535140
C -3.878173 0.490081 -0.802065
C -6.222044 0.723253 -0.122683
C -5.874579 0.387554 1.211314
C -5.213000 0.772193 -1.125498
C -7.620056 1.030189 -0.515814
H 3.593982 0.713614 -1.844494
H 5.198653 -1.161780 0.594812
H 3.154498 0.939981 2.460436
H 1.686126 -2.678620 -1.470368
H 2.715729 -1.883157 1.910331
H 4.831692 2.892879 -1.841578
H 6.527130 -3.117571 -0.227943
H 4.389198 3.133811 2.476267
H 3.013613 -4.622139 -2.297065
H 0.329586 -0.649472 1.424162
H 5.233698 4.112921 0.320790
H 5.437349 -4.855992 -1.683178
H -1.942439 -0.386989 1.976486
H -4.267440 -0.153134 2.567015
H -3.090149 0.524709 -1.560295
H -6.656887 0.352969 1.974108
H -5.504333 1.034706 -2.147709
H -9.430340 1.162927 0.232785


