%chk=000275965.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275965

0 1
O 2.571644 -0.892122 1.900072
O 2.675253 2.558377 -0.038102
O -1.417693 -3.169752 -0.446928
O -1.288951 2.191050 -0.155665
O 4.560400 1.345802 -0.566450
N 2.618205 -1.445419 -1.812976
N 1.006464 -1.821807 0.485400
N -3.672899 1.103365 -0.102990
N 4.667497 3.284065 0.713641
C 3.142425 -1.157367 -0.443124
C 2.068929 -0.726581 0.568269
C 2.825778 -2.593772 -0.876693
C 1.539214 -3.051384 -0.180644
C 1.282586 0.620644 0.418705
C -0.190956 -1.227524 0.120344
C -0.127328 0.147553 0.149368
C 1.780964 1.575857 -0.659311
C -1.469727 -1.974139 -0.227063
C -1.279028 0.976100 -0.047984
C 3.593823 0.039857 2.306149
C -2.673336 -1.151197 -0.278742
C -2.631953 0.218478 -0.149139
C -3.927061 -1.932824 -0.515405
C 4.025206 2.303300 -0.040758
C -5.115636 0.766299 -0.097166
C -5.930878 1.965977 0.412812
C -7.419927 1.637272 0.425934
H 4.148001 -0.754507 -0.279724
H 3.580421 -3.358530 -1.052999
H 3.316016 -1.358419 -2.555754
H 0.792765 -3.490366 -0.881860
H 1.761122 -3.804704 0.607158
H 1.311727 1.151370 1.409058
H 0.967489 2.246422 -1.016950
H 2.287720 1.086283 -1.506857
H 3.185477 1.054539 2.363477
H 4.456632 -0.003029 1.632487
H 3.856259 -0.331368 3.305154
H -4.639043 -1.827159 0.313568
H -3.710530 -3.012640 -0.607794
H -4.415867 -1.635784 -1.451514
H -3.441242 2.106391 -0.108092
H -5.292706 -0.122365 0.555641
H -5.438781 0.485807 -1.126488
H -5.749787 2.856370 -0.222880
H -5.598459 2.247578 1.433195
H 4.157762 4.115757 0.981711
H 5.664273 3.400647 0.587498
H -7.793448 1.388188 -0.574653
H -7.645920 0.788892 1.083343
H -8.007099 2.491019 0.787326


%chk=000275965-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000275965

0 1
O 2.466232 -1.049156 2.117272
O 2.922527 2.326201 0.143619
O -1.324256 -3.260538 -0.422366
O -1.506286 2.172354 0.569921
O 4.122868 1.668778 -1.793546
N 2.663184 -1.073598 -1.674394
N 1.043791 -1.760533 0.365940
N -3.763695 0.968261 0.092887
N 5.039180 3.074127 -0.156863
C 3.167860 -0.958517 -0.249779
C 2.032053 -0.706140 0.745337
C 2.952040 -2.328646 -0.868619
C 1.668702 -2.933785 -0.288663
C 1.214209 0.639211 0.714477
C -0.203733 -1.222163 0.209096
C -0.204813 0.150798 0.448191
C 1.661335 1.678215 -0.328945
C -1.432613 -2.000992 -0.170085
C -1.412529 0.895672 0.389466
C 3.553735 -0.211857 2.645445
C -2.692326 -1.271453 -0.226016
C -2.702852 0.106009 0.060524
C -3.913216 -2.099331 -0.598700
C 4.037268 2.303166 -0.710333
C -5.197898 0.754309 -0.149424
C -6.009582 1.955170 0.380047
C -7.520511 1.786285 0.118208
H 4.165044 -0.555652 -0.062100
H 3.790859 -2.979747 -1.130411
H 3.416116 -0.821551 -2.340385
H 0.977567 -3.349350 -1.036647
H 1.908020 -3.715117 0.455391
H 1.277397 1.107627 1.714939
H 0.912834 2.484786 -0.382764
H 1.829003 1.222073 -1.317591
H 3.369723 0.866352 2.469172
H 4.534122 -0.487958 2.208656
H 3.573383 -0.411969 3.728127
H -4.563065 -2.307574 0.272595
H -3.563476 -3.073747 -0.977607
H -4.527571 -1.623715 -1.381801
H -3.447422 1.936129 0.293519
H -5.532219 -0.170464 0.351573
H -5.395126 0.630981 -1.234838
H -5.648797 2.883583 -0.107181
H -5.822513 2.068878 1.465497
H 4.868339 3.604731 0.694046
H 5.915049 3.170590 -0.662585
H -7.731018 1.693619 -0.963653
H -7.914193 0.881732 0.618168
H -8.086933 2.654417 0.498790


