%chk=000278649.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278649

0 1
O -0.900642 -1.233339 0.623330
N 1.615414 -0.127787 -0.350557
C -0.622273 0.908951 -0.401628
C 0.787694 0.978241 0.205185
C -1.426232 -0.272715 0.098194
C -2.910740 -0.202740 -0.073459
C 3.021823 -0.085697 -0.176132
C -3.510541 0.522384 -1.112725
C -3.712726 -0.912004 0.834803
C 3.722989 1.129037 -0.022671
C 3.742040 -1.302144 -0.264267
C -4.902276 0.547196 -1.233293
C -5.104460 -0.878915 0.716313
C 5.117365 1.119428 0.027066
C 5.132784 -1.284849 -0.214394
C -5.699382 -0.148738 -0.317223
C 5.829637 -0.078931 -0.066565
H -1.155677 1.858702 -0.196291
H -0.541585 0.839997 -1.511293
H 0.727962 0.929450 1.316443
H 1.252969 1.956481 -0.057751
H 1.184430 -1.046644 -0.169487
H -2.900353 1.060525 -1.837323
H -3.237013 -1.494358 1.628754
H 3.186318 2.070619 0.042252
H 3.212931 -2.244052 -0.379412
H -5.367554 1.107625 -2.042883
H -5.723641 -1.426530 1.425668
H 5.654811 2.060473 0.141324
H 5.685037 -2.221578 -0.287791
H -6.784881 -0.124184 -0.412326
H 6.914175 -0.076905 -0.025359


%chk=000278649-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000278649

0 1
O -0.960532 -0.841929 1.257892
N 1.598759 0.003285 0.272386
C -0.599149 1.096208 -0.175463
C 0.804063 1.217770 0.458993
C -1.460471 -0.016463 0.431389
C -2.901954 -0.125970 0.028375
C 2.979011 -0.042068 0.037242
C -3.489174 0.729804 -0.943494
C -3.701288 -1.130556 0.640995
C 3.772946 1.113621 -0.230463
C 3.629533 -1.316073 0.041199
C -4.848156 0.583155 -1.293470
C -5.058259 -1.273832 0.293489
C 5.154009 0.986430 -0.496789
C 5.007239 -1.426041 -0.221400
C -5.635412 -0.416449 -0.675195
C 5.788201 -0.276350 -0.497190
H -1.132616 2.062600 -0.074844
H -0.494862 0.902103 -1.262430
H 0.694029 1.468644 1.537107
H 1.317866 2.066995 -0.021236
H 1.157129 -0.835329 0.658620
H -2.890727 1.504910 -1.433079
H -3.229923 -1.781513 1.384788
H 3.327381 2.113707 -0.225678
H 3.037095 -2.216715 0.247976
H -5.293889 1.243523 -2.045080
H -5.667572 -2.048483 0.771326
H 5.739915 1.891099 -0.699871
H 5.476045 -2.417273 -0.211349
H -6.691079 -0.527677 -0.946911
H 6.860247 -0.364135 -0.701335


