%chk=000267093.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267093

0 1
O 1.587621 0.425888 -0.284081
O -3.458778 2.477422 -0.380469
O -5.079264 -1.780188 0.396673
N -0.621528 1.237487 -0.310220
N -0.352857 -1.038555 0.050607
N -2.792540 -1.570251 0.253826
N -4.271348 0.355740 0.006804
C 3.863441 -0.146127 -0.236484
C 4.328119 0.437742 1.111152
C 4.859435 -1.205681 -0.746987
C 5.738153 1.030579 0.992300
C 6.270398 -0.611866 -0.861989
C 6.737340 -0.011874 0.471466
C 2.465918 -0.762782 -0.118435
C 0.267702 0.179101 -0.179641
C -1.911211 0.669702 -0.156979
C -1.708409 -0.720891 0.062540
C -3.201572 1.302239 -0.199696
C -0.334342 2.649646 -0.563046
C -4.125615 -1.043342 0.230294
C -2.577984 -3.019467 0.483083
C -5.673034 0.858745 -0.009259
H 3.810271 0.689162 -0.983415
H 4.317881 -0.346919 1.891397
H 3.614149 1.214419 1.445350
H 4.536417 -1.593954 -1.730964
H 4.875522 -2.073372 -0.059803
H 6.068732 1.411516 1.976805
H 5.722737 1.906670 0.315727
H 6.286964 0.166701 -1.649086
H 6.979034 -1.394776 -1.191933
H 7.734785 0.449653 0.348376
H 6.862804 -0.816919 1.220871
H 2.245677 -1.217954 0.860691
H 2.216881 -1.469627 -0.927535
H 0.300889 3.069855 0.237991
H 0.186613 2.777558 -1.529592
H -1.283623 3.231494 -0.598635
H -3.551084 -3.533025 0.606541
H -1.971858 -3.176333 1.392956
H -2.042849 -3.466170 -0.373668
H -5.678212 1.950104 -0.192674
H -6.165703 0.656040 0.957232
H -6.251971 0.359309 -0.805098


%chk=000267093-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000267093

0 1
O 1.547566 0.547604 -0.255930
O -3.575101 2.546054 -0.209941
O -5.072223 -1.899419 0.318295
N -0.688126 1.328321 -0.223084
N -0.366647 -0.939229 -0.007182
N -2.754364 -1.555326 0.175122
N -4.297120 0.297994 0.052944
C 3.885459 -0.146092 -0.344526
C 4.315569 0.642072 0.918164
C 4.842906 -1.342580 -0.596790
C 5.786720 1.110438 0.821847
C 6.314569 -0.874944 -0.693829
C 6.740695 -0.080640 0.563393
C 2.446166 -0.653022 -0.250784
C 0.214542 0.283030 -0.160654
C -1.966067 0.734967 -0.098859
C -1.722805 -0.641563 0.029956
C -3.279351 1.312315 -0.097241
C -0.378564 2.756488 -0.396067
C -4.097449 -1.103074 0.190295
C -2.467935 -2.995276 0.315898
C -5.710067 0.740884 0.070242
H 3.948209 0.534825 -1.219888
H 4.198803 -0.015319 1.806441
H 3.642128 1.506924 1.065603
H 4.552084 -1.875131 -1.524325
H 4.746270 -2.070330 0.236968
H 6.075937 1.639897 1.750057
H 5.884052 1.842279 -0.006917
H 6.433592 -0.231314 -1.589948
H 6.977869 -1.749557 -0.837454
H 7.782020 0.278576 0.452649
H 6.725834 -0.756716 1.443571
H 2.257723 -1.220203 0.680195
H 2.165715 -1.286460 -1.113109
H 0.253700 3.114186 0.434115
H 0.157139 2.918817 -1.346808
H -1.330814 3.308387 -0.404998
H -3.431456 -3.515515 0.416575
H -1.843756 -3.172049 1.207983
H -1.926740 -3.363240 -0.571958
H -5.710145 1.835018 -0.041447
H -6.187149 0.447919 1.019755
H -6.265685 0.266702 -0.755336


