%chk=000253397.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253397

0 1
O -0.909038 -1.286947 -2.335199
O -0.251689 -2.706832 2.017021
N -1.134023 -0.695831 1.169191
N -0.493167 -2.326276 -0.298644
C -1.277584 -0.068798 -0.179499
C -0.319586 1.131062 -0.423701
C -2.744191 0.324419 -0.432733
C -0.747834 2.353391 0.409031
C -3.152219 1.565503 0.367892
C -2.201118 2.740569 0.112244
C -0.888664 -1.250524 -1.132246
C 1.127045 0.750531 -0.195069
C -0.564564 -1.986791 1.101319
C 1.891601 0.312998 -1.289520
C 1.719281 0.813466 1.073837
C 3.227836 -0.052702 -1.114293
C 3.057302 0.445305 1.245998
C 3.814437 0.012380 0.154058
H -0.444016 1.409576 -1.508534
H -3.412516 -0.522905 -0.176263
H -2.884752 0.506936 -1.519025
H -0.072931 3.202531 0.181608
H -0.623568 2.154918 1.490470
H -3.176662 1.324425 1.448823
H -4.188130 1.852507 0.100885
H -2.295962 3.081733 -0.937450
H -2.494017 3.606156 0.736916
H -1.034228 -0.113257 1.990395
H -0.175805 -3.232469 -0.629326
H 1.441666 0.249847 -2.281552
H 1.144781 1.152071 1.933758
H 3.813238 -0.391442 -1.968344
H 3.508559 0.493577 2.236261
H 4.855319 -0.275224 0.289990


%chk=000253397-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253397

0 1
O -0.851095 -1.332091 -2.277476
O -0.506628 -2.737533 2.213200
N -1.147454 -0.669411 1.214174
N -0.558808 -2.344693 -0.149078
C -1.283829 -0.095987 -0.140203
C -0.304838 1.113736 -0.416294
C -2.749363 0.322460 -0.458918
C -0.751249 2.355442 0.401483
C -3.181204 1.575084 0.335152
C -2.212073 2.754210 0.091403
C -0.878294 -1.306663 -1.023096
C 1.167519 0.751130 -0.226103
C -0.713681 -1.987537 1.230930
C 1.969482 0.457717 -1.360483
C 1.770515 0.689473 1.057908
C 3.332277 0.114124 -1.219645
C 3.132363 0.343349 1.203072
C 3.919689 0.054897 0.064922
H -0.458461 1.345410 -1.490078
H -3.421054 -0.529306 -0.241913
H -2.811223 0.520584 -1.546313
H -0.066102 3.193290 0.173847
H -0.645728 2.159233 1.488530
H -3.219719 1.341190 1.419825
H -4.210609 1.856284 0.043606
H -2.285634 3.072217 -0.968620
H -2.505977 3.624623 0.708220
H -1.366431 -0.178286 2.077631
H -0.231136 -3.267605 -0.434334
H 1.516921 0.490361 -2.358959
H 1.180442 0.911922 1.953886
H 3.932359 -0.107714 -2.109286
H 3.577480 0.296278 2.203315
H 4.976341 -0.212282 0.177996


