%chk=000219148.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219148

0 1
O 3.197793 -1.265926 -0.042697
N 0.865310 -1.485217 -0.027328
N 1.992044 0.665891 -0.006284
C -2.892500 0.356282 -0.362999
C -1.744337 1.268358 0.090026
C -2.808539 -1.002810 0.337312
C -0.401502 0.598495 0.022827
C -1.519172 -1.727191 -0.054557
C -0.302794 -0.842210 -0.008088
C 0.771553 1.334355 0.023724
C 0.842993 2.825274 0.049485
C 2.082893 -0.799641 -0.026608
H -3.863585 0.839993 -0.148226
H -2.854967 0.218560 -1.461448
H -1.925676 1.597317 1.136447
H -1.748402 2.187823 -0.531143
H -3.683424 -1.627912 0.075784
H -2.847786 -0.866989 1.436323
H -1.604656 -2.140888 -1.085889
H -1.362153 -2.620421 0.591882
H 2.867647 1.194435 -0.011845
H 1.504310 3.196415 0.847920
H -0.138102 3.294730 0.219351
H 1.221552 3.225679 -0.904969


%chk=000219148-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219148

0 1
O 3.261822 -1.301724 0.045539
N 0.899408 -1.506581 0.003644
N 1.977359 0.641621 0.071853
C -2.921500 0.353401 -0.410212
C -1.765019 1.289911 0.011581
C -2.814637 -1.000725 0.323812
C -0.408056 0.595692 0.004620
C -1.515031 -1.726352 -0.081906
C -0.275932 -0.846739 -0.014472
C 0.781363 1.330042 0.057988
C 0.842385 2.839401 0.094547
C 2.105889 -0.797010 0.037757
H -3.889326 0.843526 -0.194676
H -2.883065 0.177266 -1.503919
H -1.975579 1.673493 1.033231
H -1.743979 2.178934 -0.649156
H -3.684916 -1.640548 0.087583
H -2.828297 -0.829391 1.418932
H -1.603389 -2.091372 -1.126005
H -1.328651 -2.622518 0.535336
H 2.866883 1.149549 0.108491
H 1.869101 3.203079 0.272162
H 0.193125 3.240488 0.892423
H 0.488539 3.270958 -0.860152


