%chk=000238355.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238355

0 1
N -0.820754 -0.489932 1.183954
N 2.251509 1.079531 -0.578820
C 0.141133 -1.429314 0.544541
C 0.821014 -0.897155 -0.733988
C -2.047648 -0.244606 0.493125
C 2.160019 -0.274457 -0.453104
C -0.144442 0.696878 1.778202
C -2.591455 -1.233006 -0.361230
C -2.802797 0.924058 0.745441
C 3.269973 -1.066367 -0.087026
C -3.852048 -1.055114 -0.927770
C -4.062032 1.082421 0.168817
C -4.596022 0.100363 -0.670958
C 4.494082 -0.441969 0.152689
C 3.452491 1.670532 -0.343727
C 4.596911 0.947516 0.024903
H -0.403813 -2.373591 0.308412
H 0.902414 -1.701537 1.310201
H 0.943556 -1.719038 -1.468161
H 0.151521 -0.161456 -1.239310
H 0.148836 1.454688 1.030073
H 0.764620 0.378562 2.312294
H -0.812551 1.165126 2.520297
H -2.036720 -2.144538 -0.569708
H -2.416183 1.705210 1.394177
H 3.169391 -2.144478 0.001621
H -4.260109 -1.827029 -1.579640
H -4.634635 1.986500 0.374966
H -5.576100 0.233412 -1.117704
H 5.365452 -1.032556 0.435994
H 3.478592 2.760389 -0.460728
H 5.539596 1.456459 0.204065


%chk=000238355-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238355

0 1
N -0.706620 -0.461097 1.059100
N 1.972324 0.821444 -0.775486
C 0.094615 -1.614593 0.639858
C 0.921423 -1.406572 -0.677911
C -1.935649 -0.172141 0.441622
C 2.130242 -0.512794 -0.492056
C -0.113722 0.511567 1.987339
C -2.502637 -1.031211 -0.554965
C -2.679979 0.995573 0.804810
C 3.365233 -1.033211 -0.017219
C -3.755383 -0.742410 -1.131356
C -3.930319 1.270309 0.215720
C -4.487722 0.407177 -0.755272
C 4.461049 -0.163935 0.172139
C 3.040742 1.650121 -0.586332
C 4.299406 1.211189 -0.116529
H -0.568351 -2.489565 0.500152
H 0.787016 -1.876590 1.461573
H 1.245817 -2.404161 -1.033025
H 0.260765 -0.963083 -1.442407
H 0.087499 1.484232 1.495687
H 0.845995 0.118624 2.359766
H -0.771736 0.688293 2.861736
H -1.969448 -1.925315 -0.891048
H -2.283022 1.693264 1.547425
H 3.461006 -2.105401 0.187864
H -4.158421 -1.423579 -1.890496
H -4.472189 2.173825 0.520301
H -5.458477 0.627795 -1.210833
H 5.421598 -0.549916 0.530665
H 2.870654 2.705806 -0.829705
H 5.122092 1.921855 0.010782


