%chk=000240063.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240063

0 1
O -6.358166 -1.991336 0.373760
O 6.465369 -1.792327 -0.661875
O -3.021948 -0.800264 -1.155537
O 3.183662 -0.953423 1.197848
N -2.779952 1.317322 -0.212184
N 2.830680 1.273525 0.601029
N -4.862843 0.606226 -1.129907
N 4.982208 0.501172 1.269590
C -0.620120 2.499344 -0.043023
C -1.351486 1.284949 -0.049895
C 1.412258 1.229724 0.402958
C 0.757235 2.460006 0.194061
C -0.687379 0.062293 0.155001
C 0.685234 0.028850 0.379868
C -1.284376 3.818553 -0.279455
C -5.760641 -0.528766 -1.474671
C 5.930150 -0.636400 1.409246
C -3.501971 0.274271 -0.841066
C 3.618402 0.168262 1.010852
C -6.701540 -0.852080 -0.373555
C 6.821201 -0.766205 0.229715
C -7.855622 -0.293506 0.117674
C 7.936553 -0.107980 -0.226277
C -8.272450 -1.110583 1.230210
C 8.314374 -0.739653 -1.466107
C -7.349848 -2.117470 1.349347
C 7.409004 -1.744311 -1.690475
H 1.318676 3.391241 0.209822
H -1.251766 -0.878389 0.124523
H 1.187679 -0.932787 0.541475
H -3.213628 2.234641 -0.116978
H -1.852253 3.823232 -1.221185
H -1.966961 4.080096 0.541188
H -0.559237 4.641590 -0.354140
H 3.251016 2.203066 0.575928
H -6.323636 -0.240550 -2.396834
H -5.144755 -1.431986 -1.745335
H 5.356985 -1.590956 1.577880
H 6.531437 -0.459033 2.335377
H -5.317904 1.330964 -0.574234
H 5.386925 1.320662 0.817434
H -8.374848 0.572874 -0.241417
H 8.454360 0.710732 0.233018
H -9.144946 -0.939393 1.830310
H 9.151640 -0.456722 -2.074184
H -7.203409 -2.958665 1.989701
H 7.248738 -2.485811 -2.441379


%chk=000240063-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240063

0 1
O -7.113487 -0.498746 1.335774
O 7.204924 -0.323749 -1.374891
O -3.349963 -1.530823 -0.471144
O 3.492403 -1.520117 0.393376
N -2.766633 0.763020 -0.363969
N 2.869843 0.761187 0.453264
N -4.977474 0.114832 -0.778595
N 5.096605 0.127063 0.806956
C -0.654573 1.937186 -0.008314
C -1.357003 0.700297 -0.158204
C 1.462333 0.680186 0.245309
C 0.740666 1.901520 0.191243
C -0.639816 -0.521974 -0.102227
C 0.754347 -0.538636 0.094600
C -1.383235 3.270608 -0.061320
C -6.065642 -0.868638 -0.894349
C 6.201649 -0.843435 0.845746
C -3.663473 -0.303507 -0.530512
C 3.788277 -0.295380 0.537987
C -7.267684 -0.520096 -0.070213
C 7.384217 -0.427948 0.024322
C -8.585052 -0.221173 -0.386637
C 8.702644 -0.128885 0.336206
C -9.293461 -0.004510 0.859755
C 9.385908 0.173112 -0.906473
C -8.371433 -0.177662 1.876776
C 8.448470 0.048294 -1.916477
H 1.276353 2.854108 0.306592
H -1.189156 -1.458569 -0.212136
H 1.298827 -1.483465 0.129714
H -3.162320 1.703932 -0.374807
H -1.885769 3.433804 -1.036822
H -2.150644 3.360113 0.734802
H -0.679718 4.107808 0.078790
H 3.239396 1.710587 0.533661
H -6.396291 -0.976195 -1.946203
H -5.625163 -1.836192 -0.588863
H 5.770249 -1.797844 0.489883
H 6.551839 -1.007837 1.883778
H -5.218304 1.104239 -0.849251
H 5.321623 1.113600 0.940862
H -9.002314 -0.167150 -1.390733
H 9.136626 -0.129269 1.334641
H -10.345668 0.245438 0.979726
H 10.432251 0.445579 -1.028711
H -8.415764 -0.121092 2.960736
H 8.472690 0.171379 -2.995544


