%chk=000238723.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238723

0 1
O 1.920039 0.790171 -0.533634
O 5.374975 0.706241 0.736811
O 4.056725 -2.040718 1.325945
O 1.316016 1.800963 1.399467
O -5.088384 -0.770632 0.068498
O -4.387459 -1.450963 -1.863230
N -4.226947 -0.912802 -0.781474
C 4.013061 0.292460 0.626248
C 3.290744 1.238510 -0.349414
C 3.912045 -1.180676 0.195754
C -0.340930 0.596294 0.092150
C 1.000538 1.142498 0.439165
C -1.367350 0.736198 1.039726
C -0.577859 -0.034069 -1.137851
C -2.868570 -0.385577 -0.474924
C -2.641980 0.242139 0.757539
C -1.850370 -0.530041 -1.427231
H 3.633538 0.428054 1.672646
H 3.685057 1.196648 -1.379352
H 3.301623 2.280732 0.023550
H 4.663504 -1.445676 -0.568083
H 2.897217 -1.427715 -0.180464
H -1.163063 1.233045 1.995144
H 0.234550 -0.135256 -1.864723
H -3.458342 0.339703 1.483251
H -2.058828 -1.026854 -2.382088
H 5.863441 0.573627 -0.101424
H 4.916507 -1.870204 1.773796


%chk=000238723-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000238723

0 1
O 1.896935 0.697689 -0.459155
O 5.401981 0.675894 0.969318
O 4.849581 -2.150200 1.014044
O 1.169938 1.826574 1.453344
O -5.334564 -0.483323 -0.025071
O -4.526524 -1.539219 -1.878823
N -4.375854 -0.814070 -0.822344
C 4.039856 0.155988 0.695612
C 3.285828 1.163693 -0.191348
C 4.143880 -1.257344 0.099271
C -0.434605 0.589207 0.093219
C 0.919310 1.107146 0.458670
C -1.521327 0.928151 0.941317
C -0.648504 -0.214913 -1.056574
C -3.005779 -0.326614 -0.502735
C -2.818372 0.470866 0.647649
C -1.941738 -0.678534 -1.361733
H 3.579367 0.108383 1.696006
H 3.741394 1.242292 -1.194923
H 3.258566 2.148451 0.305011
H 4.655697 -1.205445 -0.891424
H 3.143817 -1.696724 -0.047922
H -1.328060 1.548418 1.821874
H 0.197810 -0.466023 -1.700321
H -3.675310 0.714214 1.280578
H -2.140874 -1.298659 -2.239266
H 5.887166 0.789716 0.109162
H 5.629883 -1.649514 1.372363


