%chk=000210151.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210151

0 1
O 3.348123 -0.333335 -1.620838
O 0.218103 3.016386 -2.305578
O -1.729553 0.788547 -0.405982
O -2.712495 2.034583 2.054812
N 2.856649 -2.049232 0.650567
C 1.095552 -0.016678 -0.597649
C 2.641941 0.223277 -0.493590
C 3.186684 -0.584255 0.713884
C 0.783655 -1.535649 -0.672402
C 2.991968 1.723899 -0.421303
C 0.612993 0.705769 -1.870299
C 0.439830 0.503199 0.682350
C 2.563568 -0.030143 2.014386
C 2.025095 -2.426789 -0.539549
C 1.174840 0.533015 1.882202
C 2.432169 2.517282 -1.598950
C 0.994987 2.167480 -1.932903
C -0.909840 0.914088 0.732582
C 4.104274 -2.873932 0.668133
C 0.606518 1.080687 3.051080
C -1.456573 1.514681 1.883761
C -0.678708 1.597703 3.057485
C -2.474797 -0.386600 -0.515914
C -3.521558 2.313012 0.881220
C -2.561505 -1.377752 0.466454
C -3.167120 -0.469542 -1.737266
C -3.367785 -2.490388 0.207388
C -3.963294 -1.590351 -1.965248
C -4.064566 -2.601255 -0.999546
H 4.296342 -0.433087 0.753560
H 0.264090 -1.782283 -1.616940
H 0.064312 -1.806952 0.130005
H 4.094334 1.835739 -0.390147
H 2.615744 2.160685 0.526172
H -0.495998 0.622316 -1.971526
H 1.012703 0.190667 -2.767523
H 3.240685 0.735183 2.443705
H 2.529771 -0.859154 2.762633
H 1.702452 -3.480361 -0.383679
H 2.610363 -2.396615 -1.488557
H 3.052107 2.368191 -2.506919
H 2.502303 3.606699 -1.387299
H 3.072560 0.094028 -2.453567
H 4.769221 -2.718099 -0.195519
H 3.828170 -3.939881 0.704973
H 4.666818 -2.657117 1.589490
H 1.192773 1.104107 3.971139
H -1.111437 2.054197 3.946577
H -2.916920 2.728012 0.067232
H -4.234276 3.049446 1.270409
H -4.023039 1.390924 0.572509
H -2.025529 -1.285839 1.408855
H -3.076819 0.328806 -2.469814
H -3.452059 -3.276345 0.958439
H -4.511374 -1.679752 -2.903365
H -4.688350 -3.471119 -1.189731


%chk=000210151-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210151

0 1
O 3.514270 -0.250887 -1.776782
O 0.322716 3.399709 -1.911116
O -1.671559 0.486950 -0.491580
O -2.843842 1.504651 1.939504
N 2.722651 -1.917517 0.590169
C 1.234657 0.094980 -0.759872
C 2.783266 0.305255 -0.608451
C 3.258818 -0.523652 0.603798
C 0.942876 -1.419547 -1.089154
C 3.167549 1.804690 -0.468914
C 0.742180 0.986590 -1.958412
C 0.551475 0.478198 0.584415
C 2.765319 0.170055 1.892063
C 2.080960 -2.376635 -0.661577
C 1.289477 0.550185 1.805926
C 2.646095 2.678602 -1.642137
C 1.148920 2.451522 -1.843312
C -0.855079 0.710671 0.658180
C 3.671918 -2.893361 1.148310
C 0.636989 0.936602 3.003173
C -1.481557 1.190463 1.840428
C -0.720684 1.291721 3.025281
C -2.575571 -0.610410 -0.495106
C -3.463810 2.301454 0.855114
C -2.631399 -1.590974 0.520925
C -3.424891 -0.675408 -1.623485
C -3.556903 -2.651432 0.391921
C -4.340625 -1.742725 -1.736629
C -4.411953 -2.736293 -0.730755
H 4.372391 -0.530644 0.578563
H 0.776270 -1.537624 -2.176151
H 0.005489 -1.712126 -0.587844
H 4.269865 1.875510 -0.408123
H 2.753261 2.224434 0.462112
H -0.346972 0.916478 -2.075381
H 1.208989 0.578159 -2.880288
H 3.387084 1.057479 2.128326
H 2.898102 -0.533858 2.734859
H 1.650107 -3.377062 -0.460862
H 2.816066 -2.484564 -1.490118
H 3.172364 2.420517 -2.586806
H 2.836670 3.748057 -1.450846
H 3.331786 0.311650 -2.571482
H 4.564496 -3.064415 0.495663
H 3.164653 -3.864384 1.296022
H 4.035284 -2.551946 2.135300
H 1.218122 0.974497 3.932283
H -1.219176 1.636787 3.935758
H -2.731023 2.992953 0.402359
H -4.270921 2.866323 1.348183
H -3.884646 1.644684 0.075811
H -1.977429 -1.524039 1.395115
H -3.353590 0.101547 -2.391287
H -3.607419 -3.412716 1.178352
H -4.998720 -1.796779 -2.610974
H -5.125266 -3.562277 -0.820069


