%chk=000280435.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280435

0 1
O 4.191184 -2.173002 -1.279148
O -5.617294 2.026685 -1.201630
N 0.746671 -1.528565 -0.024294
N -2.044974 -0.799861 0.156725
C 0.072677 -0.764289 -1.125555
C -0.248015 -2.433825 0.641294
C -1.065835 0.090883 -0.533608
C -1.386987 -1.585033 1.242429
C 1.909699 -2.312408 -0.543599
C 3.122739 -1.367848 -0.726469
C -3.376253 -0.364186 0.328019
C 3.678333 -0.841505 0.601183
C 4.515512 0.393130 0.415671
C -3.895810 0.675448 -0.468718
C -4.241494 -1.038564 1.233606
C -5.256027 0.999575 -0.356314
C -5.582063 -0.682483 1.313944
C 5.684094 0.334229 -0.361708
C 4.146223 1.602605 1.021072
C -6.121192 0.341621 0.526981
C 6.474068 1.472446 -0.526760
C 4.942310 2.740183 0.853137
C 6.105728 2.678421 0.081263
C -6.996463 2.466724 -1.184396
H -0.330528 -1.422547 -1.926171
H 0.822667 -0.090871 -1.594612
H 0.268158 -2.978396 1.461333
H -0.671668 -3.195145 -0.049723
H -0.648917 0.847637 0.169174
H -1.574953 0.645065 -1.355623
H -2.131570 -2.258243 1.726120
H -0.983267 -0.911993 2.032784
H 1.703210 -2.844873 -1.495387
H 2.185674 -3.103367 0.189140
H 2.894467 -0.542084 -1.433880
H 4.292782 -1.637852 1.077891
H 2.831655 -0.653008 1.297577
H -3.281516 1.223429 -1.177307
H -3.860184 -1.844876 1.853310
H 4.051151 -2.337518 -2.227422
H -6.234557 -1.212546 2.010216
H 5.959646 -0.610560 -0.835740
H 3.241151 1.659577 1.621931
H -7.166575 0.601369 0.609261
H 7.379756 1.422025 -1.128250
H 4.653048 3.676572 1.326552
H 6.723705 3.563798 -0.046505
H -7.257729 2.856312 -0.196366
H -7.658357 1.650781 -1.488488
H -6.987385 3.267633 -1.934540


%chk=000280435-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000280435

0 1
O 4.346688 -2.249845 -1.082326
O -5.453164 2.373050 -0.853249
N 0.745830 -1.674377 -0.023839
N -2.066810 -0.967448 0.072891
C 0.076675 -1.031530 -1.180592
C -0.228769 -2.527720 0.698857
C -1.116871 -0.171906 -0.727465
C -1.411056 -1.680117 1.194675
C 1.986758 -2.392005 -0.389654
C 3.184433 -1.441958 -0.644190
C -3.403860 -0.514727 0.216169
C 3.617192 -0.700927 0.634707
C 4.476986 0.531607 0.390635
C -3.830827 0.719659 -0.344548
C -4.377562 -1.313112 0.899047
C -5.180564 1.131469 -0.247129
C -5.709558 -0.878032 0.995672
C 5.760674 0.423774 -0.209420
C 4.009399 1.819256 0.760023
C -6.143318 0.343455 0.425833
C 6.549840 1.573613 -0.433879
C 4.798000 2.972095 0.537552
C 6.073081 2.852825 -0.060782
C -6.824111 2.876589 -0.766554
H -0.287780 -1.801222 -1.908508
H 0.795226 -0.378582 -1.707076
H 0.276171 -2.986189 1.568991
H -0.618137 -3.350317 0.046647
H -0.739405 0.707086 -0.154436
H -1.630873 0.201025 -1.630023
H -2.136001 -2.336609 1.699303
H -1.033436 -0.948197 1.945380
H 1.841630 -3.039016 -1.295739
H 2.265176 -3.064089 0.444128
H 2.928002 -0.704358 -1.434126
H 4.161745 -1.438978 1.257178
H 2.692665 -0.421217 1.172126
H -3.139002 1.403266 -0.841670
H -4.104792 -2.284248 1.321424
H 4.144146 -2.660569 -1.961548
H -6.438343 -1.511570 1.514669
H 6.122059 -0.567373 -0.502703
H 3.021379 1.918017 1.227329
H -7.188488 0.651396 0.510933
H 7.538886 1.472999 -0.896327
H 4.420181 3.958060 0.832448
H 6.688197 3.743741 -0.231955
H -7.133940 3.027331 0.286294
H -7.538076 2.192720 -1.266216
H -6.809581 3.843906 -1.290556


