%chk=000225401.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225401

0 1
O -3.050247 -0.003774 -1.237442
O 2.450041 -0.976051 2.240359
N 1.457574 0.137405 0.506412
N -3.179824 -1.015438 1.500262
C -0.709760 -0.186229 -1.370196
C -1.958892 -0.706134 -0.610457
C -0.261977 1.179090 -0.914057
C 0.416521 -1.187134 -1.289922
C 0.839515 1.323506 -0.040108
C 1.476314 -1.016772 -0.370106
C -1.934023 -0.431098 0.905793
C -0.908234 2.325720 -1.389782
C 0.433292 -2.295035 -2.145423
C 1.345267 2.599587 0.255693
C 2.528966 -1.944168 -0.315708
C 1.842735 0.011940 1.875056
C -0.440629 3.597318 -1.047560
C 1.475578 -3.223718 -2.086074
C 0.695948 3.730532 -0.244932
C 2.518818 -3.046225 -1.172534
C -3.561364 -0.289862 2.748354
C -3.007181 -2.472152 1.780568
C 1.451797 1.106612 2.821979
H -1.032031 -0.093440 -2.449530
H -2.109934 -1.791145 -0.819779
H -1.921054 0.668972 1.071665
H -0.995966 -0.828753 1.346292
H -1.792128 2.212707 -2.024022
H -0.374547 -2.435114 -2.863841
H 2.247359 2.713083 0.853328
H 3.340871 -1.814669 0.405742
H -3.859839 -0.086329 -0.679370
H -0.954444 4.482277 -1.418562
H 1.475202 -4.083487 -2.753243
H 1.083756 4.721216 -0.010435
H 3.332699 -3.769324 -1.126304
H -2.814375 -0.329216 3.554280
H -4.503582 -0.713423 3.133332
H -3.759409 0.766547 2.505453
H -2.741101 -2.994753 0.847397
H -3.970164 -2.886294 2.120112
H -2.243044 -2.711003 2.535199
H 0.477432 1.562868 2.601017
H 2.200984 1.912345 2.837857
H 1.406276 0.704618 3.848437


%chk=000225401-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225401

0 1
O -3.107376 -0.054180 -0.914535
O 2.388028 -0.930984 2.334959
N 1.405797 0.168575 0.510385
N -3.112762 -0.899890 1.610238
C -0.708561 -0.256551 -1.371441
C -1.917964 -0.820376 -0.550649
C -0.294300 1.152299 -0.979982
C 0.494883 -1.190918 -1.324132
C 0.778301 1.339024 -0.066381
C 1.531973 -0.977163 -0.375194
C -1.763551 -0.751986 0.992592
C -0.921298 2.288662 -1.539401
C 0.600679 -2.281520 -2.217482
C 1.263984 2.641099 0.206183
C 2.651142 -1.842832 -0.327935
C 1.744652 0.062402 1.885570
C -0.481799 3.591993 -1.221295
C 1.703561 -3.160688 -2.166262
C 0.625706 3.765209 -0.358373
C 2.727378 -2.935179 -1.218357
C -3.212939 -0.263791 2.943511
C -3.593778 -2.303572 1.623830
C 1.263931 1.149722 2.845667
H -1.095094 -0.228653 -2.408452
H -2.044163 -1.879334 -0.870170
H -1.391647 0.251713 1.263870
H -1.035129 -1.511171 1.354695
H -1.766352 2.134513 -2.217695
H -0.191658 -2.435891 -2.960160
H 2.145151 2.772299 0.841390
H 3.439851 -1.669198 0.403956
H -3.655136 -0.073811 -0.062227
H -0.983086 4.462630 -1.657128
H 1.768931 -4.004073 -2.861983
H 1.004219 4.769398 -0.138608
H 3.594532 -3.603104 -1.174512
H -2.557137 -0.746152 3.706819
H -4.255730 -0.322087 3.302714
H -2.933530 0.801417 2.867716
H -3.592387 -2.713207 0.599782
H -4.631119 -2.333474 2.000346
H -2.964789 -2.963585 2.266257
H 0.375868 1.698214 2.496494
H 2.067551 1.882927 3.038226
H 1.048361 0.646877 3.802353


