%chk=000259310.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259310

0 1
O 2.790862 2.260312 -0.980488
N 2.383690 0.717341 0.665571
N 0.371639 2.813563 0.431834
C -0.728035 -1.308375 0.067902
C -1.741097 -0.264320 -0.009420
C 0.631989 -0.955376 0.231701
C -1.363159 1.094576 0.066429
C 0.998350 0.445583 0.367846
C 0.047817 1.449864 0.259248
C -1.078755 -2.680700 -0.034417
C -3.116112 -0.588403 -0.172210
C 1.610089 -1.989246 0.250694
C -2.368932 2.093821 -0.030967
C -0.116564 -3.670074 0.007198
C 1.243928 -3.316572 0.142811
C -4.076856 0.398672 -0.261475
C -3.698749 1.757633 -0.191739
C 3.222333 1.535180 -0.095939
C 4.671988 1.492301 0.304014
H -2.130971 -2.950148 -0.150513
H -3.407942 -1.639240 -0.227063
H 2.664988 -1.735339 0.330388
H -2.089678 3.147642 0.028087
H 2.762151 0.165987 1.434880
H -0.393944 -4.719075 -0.070018
H 1.999842 -4.100591 0.156745
H -5.127672 0.140600 -0.386133
H -4.461258 2.531129 -0.264216
H 1.311249 3.085514 0.137789
H -0.311082 3.469707 0.066382
H 4.832702 1.806135 1.343410
H 5.251997 2.182414 -0.332352
H 5.113090 0.495785 0.175220


%chk=000259310-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259310

0 1
O 2.932976 2.567594 -0.794043
N 2.394389 0.676183 0.489156
N 0.420617 2.782423 0.221469
C -0.758283 -1.348959 0.044875
C -1.774488 -0.294267 0.012887
C 0.634237 -0.974642 0.078063
C -1.369751 1.087601 -0.008061
C 1.010259 0.423812 0.180768
C 0.048636 1.450799 0.118076
C -1.091928 -2.735248 0.019963
C -3.171561 -0.590489 -0.028181
C 1.624416 -2.011478 0.030561
C -2.374291 2.099180 -0.114187
C -0.107626 -3.734137 0.012187
C 1.264331 -3.365095 0.003865
C -4.139840 0.418327 -0.106387
C -3.736814 1.779658 -0.161060
C 3.267896 1.643803 0.022828
C 4.690103 1.553908 0.567520
H -2.141812 -3.041588 -0.001107
H -3.505895 -1.631325 -0.003072
H 2.685406 -1.748557 -0.038065
H -2.094174 3.155558 -0.184074
H 2.806200 -0.011871 1.126331
H -0.395358 -4.790514 -0.007083
H 2.040634 -4.136923 -0.042115
H -5.203204 0.157653 -0.136566
H -4.485388 2.574284 -0.247688
H 1.349262 3.043837 -0.153718
H -0.296713 3.499552 0.279130
H 4.897283 2.438038 1.195833
H 5.394375 1.583994 -0.280740
H 4.884005 0.645185 1.163834


