%chk=000232855.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232855

0 1
O -0.000352 -2.673270 -0.396012
O 0.000544 2.672701 -0.398159
O 7.527639 1.085872 0.370541
O -7.527860 -1.085330 0.369816
N -1.187365 -0.757021 -0.315107
N 1.187537 0.756526 -0.315254
C -1.299082 0.657235 -0.247070
C 1.299231 -0.657680 -0.246253
C 0.029703 -1.458007 -0.328120
C -0.029528 1.457495 -0.329267
C -2.476156 1.307942 -0.131064
C 2.476293 -1.308265 -0.129587
C -3.794198 0.676398 -0.017034
C 3.794253 -0.676525 -0.015779
C -4.799614 1.011137 -0.939577
C 4.799773 -1.011579 -0.938078
C -4.071705 -0.232312 1.023954
C 4.071534 0.232746 1.024777
C -6.067550 0.435830 -0.847387
C 6.067634 -0.436067 -0.846053
C -5.329577 -0.812540 1.139716
C 5.329316 0.813190 1.140365
C 6.313835 0.470381 0.195647
C -6.313961 -0.470081 0.194737
H -2.056396 -1.300289 -0.382070
H 2.056598 1.299737 -0.382293
H -2.480059 2.409014 -0.125900
H 2.480266 -2.409327 -0.123556
H -4.587516 1.722080 -1.739866
H 4.587835 -1.722931 -1.738044
H -3.295969 -0.472551 1.753568
H 3.295670 0.473277 1.754155
H -6.841256 0.689417 -1.565201
H 6.841428 -0.689903 -1.563685
H -5.568851 -1.514667 1.936577
H 5.568429 1.515758 1.936886
H 8.188374 0.813527 -0.313606
H -8.188499 -0.813219 -0.314517


%chk=000232855-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000232855

0 1
O 0.197171 -2.732394 -0.354553
O -0.197098 2.732167 -0.356301
O 7.828529 1.072813 0.250928
O -7.828549 -1.072740 0.250073
N -1.100971 -0.813194 -0.274784
N 1.101029 0.813018 -0.275065
C -1.335716 0.579163 -0.214865
C 1.335762 -0.579303 -0.214235
C 0.136284 -1.466588 -0.289239
C -0.136223 1.466402 -0.290182
C -2.580410 1.167550 -0.149810
C 2.580440 -1.167658 -0.148574
C -3.905517 0.557480 -0.030994
C 3.905532 -0.557529 -0.029884
C -5.033901 1.310218 -0.476663
C 5.033989 -1.310548 -0.474895
C -4.163034 -0.729743 0.541173
C 4.162958 0.730031 0.541563
C -6.341845 0.799525 -0.404573
C 6.341925 -0.799827 -0.402872
C -5.466133 -1.247843 0.627324
C 5.466047 1.248168 0.627641
C 6.558308 0.490806 0.141917
C -6.558314 -0.490785 0.140948
H -1.907025 -1.438412 -0.370076
H 1.907101 1.438179 -0.370582
H -2.542027 2.261072 -0.231467
H 2.542062 -2.261229 -0.229562
H -4.870909 2.308824 -0.898143
H 4.871059 -2.309403 -0.895807
H -3.352043 -1.307841 0.997852
H 3.351893 1.308403 0.997757
H -7.186760 1.400331 -0.764971
H 7.186900 -1.400858 -0.762755
H -5.660475 -2.224811 1.079052
H 5.660319 2.225403 1.078822
H 8.529936 0.472489 -0.105323
H -8.529894 -0.472638 -0.106673


