%chk=000235668.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235668

0 1
O -1.398863 -0.963562 -0.090100
O -1.308186 0.468954 1.649440
N 2.333364 -0.793289 0.006220
C 0.948714 -0.371232 -0.392034
C 4.704982 -0.121557 0.282557
C 3.386431 0.168942 -0.450251
C 5.862975 0.749252 -0.248782
C -0.024691 -1.428883 0.201944
C 0.818815 -0.274026 -1.913414
C 0.020244 -2.797963 -0.444408
C 5.691288 2.218357 0.157806
C 7.203596 0.206689 0.265479
C -1.941522 -0.004476 0.728703
C -3.327470 0.322928 0.316222
C -4.017576 1.311140 1.037107
C -3.944970 -0.329979 -0.760774
C -5.324700 1.643879 0.676034
C -5.252959 0.008245 -1.116040
C -5.941035 0.993304 -0.399001
H 0.669714 0.623857 0.054089
H 4.586675 0.034563 1.370894
H 4.960061 -1.194182 0.160707
H 3.520956 0.018953 -1.544863
H 3.092959 1.231437 -0.303997
H 0.076394 -1.481599 1.309507
H 5.868591 0.690400 -1.366135
H 2.375435 -0.878555 1.030551
H 1.285985 0.635013 -2.304107
H 1.292422 -1.130426 -2.410885
H -0.239106 -0.260248 -2.206782
H -0.515907 -3.546750 0.148471
H -0.434807 -2.785716 -1.444008
H 1.064599 -3.127535 -0.563176
H 4.751586 2.633540 -0.221255
H 5.686353 2.338530 1.246599
H 6.505649 2.836682 -0.234454
H 8.042081 0.806851 -0.103795
H 7.252468 0.218146 1.359613
H 7.370938 -0.825190 -0.060943
H -3.524134 1.810340 1.875623
H -3.396813 -1.098618 -1.311977
H -5.863712 2.409498 1.232220
H -5.736510 -0.496096 -1.951230
H -6.961715 1.254980 -0.678476


%chk=000235668-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235668

0 1
O -1.434091 -0.972022 -0.174557
O -1.391922 0.374458 1.735699
N 2.306114 -0.674365 -0.031850
C 0.943028 -0.367673 -0.542798
C 4.696601 -0.081822 0.270642
C 3.388256 0.238001 -0.480207
C 5.935104 0.716231 -0.217199
C -0.022338 -1.406126 0.098515
C 0.897568 -0.388015 -2.083114
C 0.103624 -2.832419 -0.431605
C 5.787552 2.239216 0.021595
C 7.216639 0.184531 0.468297
C -2.001234 -0.065190 0.726355
C -3.400392 0.295721 0.350253
C -4.102115 1.204414 1.184634
C -4.031730 -0.238563 -0.803120
C -5.425120 1.575074 0.868683
C -5.355895 0.135272 -1.115194
C -6.054389 1.041333 -0.281726
H 0.597153 0.639821 -0.200720
H 4.555821 0.107872 1.357630
H 4.892421 -1.166982 0.159959
H 3.551295 0.089894 -1.564815
H 3.114443 1.312183 -0.334508
H 0.116740 -1.372804 1.197771
H 6.036727 0.547193 -1.311101
H 2.292415 -0.711672 1.000122
H 1.424600 0.483400 -2.509289
H 1.371167 -1.304519 -2.476874
H -0.150777 -0.347906 -2.427951
H -0.518333 -3.526009 0.159643
H -0.214029 -2.895644 -1.486222
H 1.160526 -3.143411 -0.363189
H 4.933625 2.666577 -0.534100
H 5.631477 2.449330 1.097864
H 6.699510 2.777231 -0.298114
H 8.114635 0.719381 0.106799
H 7.159944 0.324870 1.565351
H 7.359851 -0.894627 0.272721
H -3.593408 1.602671 2.068791
H -3.480034 -0.938670 -1.436437
H -5.965502 2.275999 1.514017
H -5.844068 -0.277300 -2.004832
H -7.082855 1.329662 -0.526918


