%chk=000242113.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242113

0 1
O 5.854687 1.351422 0.929759
O 0.898904 -1.298251 0.371900
O -5.228520 0.403570 1.077287
N 4.003703 -0.220003 -0.557905
N 1.994428 -1.002294 -1.656560
N -0.233142 -0.212552 -1.347782
C 3.798147 0.024453 0.906045
C 5.464752 -0.253929 -0.882109
C 4.451258 1.364631 1.271035
C 6.078468 1.096224 -0.470205
C 3.276787 -1.439410 -1.028381
C 0.883026 -0.852986 -0.765815
C -1.519693 -0.080964 -0.723232
C -2.560792 0.454476 -1.500489
C -1.749228 -0.441521 0.623388
C -4.042943 0.282217 0.389901
C -3.830977 0.640749 -0.945083
C -3.005334 -0.261214 1.180089
C -6.384016 0.950505 0.365382
C -7.475528 0.930471 1.417596
H 2.702245 0.054301 1.110719
H 4.219458 -0.786496 1.539164
H 6.000636 -1.080569 -0.367099
H 5.586695 -0.404463 -1.975218
H 3.965669 2.213614 0.759212
H 4.475068 1.535231 2.361626
H 7.180341 1.090368 -0.538250
H 5.659707 1.930864 -1.059675
H 3.849661 -1.975728 -1.821890
H 3.048518 -2.171474 -0.213022
H 2.136826 -0.255364 -2.344919
H -0.199680 0.039260 -2.336456
H -2.395197 0.732107 -2.539680
H -0.937356 -0.867867 1.226607
H -4.623918 1.056757 -1.557227
H -3.210454 -0.531027 2.215213
H -6.606617 0.295795 -0.494344
H -6.134954 1.970575 0.026724
H -7.195683 1.534531 2.292384
H -7.651493 -0.089403 1.788359
H -8.420659 1.318291 1.022550


%chk=000242113-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242113

0 1
O 6.297921 1.235913 0.853401
O 0.838460 -1.537104 0.408724
O -5.524244 0.134251 1.083635
N 4.232235 -0.107065 -0.671698
N 1.972236 -0.594601 -1.413549
N -0.306241 -0.147154 -1.123536
C 3.937256 0.488314 0.660040
C 5.647263 -0.555655 -0.741255
C 4.889132 1.665443 0.919349
C 6.575373 0.639635 -0.462972
C 3.268433 -1.165558 -1.056234
C 0.827672 -0.809114 -0.630508
C -1.610919 -0.098744 -0.549709
C -2.600746 0.652264 -1.231589
C -1.958767 -0.757187 0.663223
C -4.253557 0.102799 0.481217
C -3.915465 0.757560 -0.728509
C -3.267404 -0.650027 1.164639
C -6.582333 0.905062 0.406027
C -7.839448 0.778676 1.262952
H 2.890340 0.841611 0.672636
H 4.050063 -0.268440 1.473788
H 5.865370 -1.362927 0.001022
H 5.852582 -0.954948 -1.753516
H 4.707832 2.464818 0.168275
H 4.753369 2.072107 1.934832
H 7.631117 0.323589 -0.426590
H 6.440514 1.404995 -1.258076
H 3.700600 -1.702543 -1.922639
H 3.068709 -1.899645 -0.244871
H 1.981196 0.119993 -2.144017
H -0.208648 0.348596 -2.012008
H -2.348262 1.165987 -2.168965
H -1.202647 -1.342537 1.188812
H -4.651411 1.345646 -1.284114
H -3.547216 -1.151420 2.096396
H -6.746912 0.493802 -0.612066
H -6.266805 1.965307 0.310946
H -7.661112 1.180246 2.275010
H -8.140464 -0.278496 1.357972
H -8.672272 1.341448 0.803122


