%chk=000225358.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225358

0 1
O 3.516195 0.163669 0.383854
O -3.515833 0.164579 -0.384326
N 0.000048 -0.294361 -0.000337
N 2.435923 -1.672445 -0.409542
N -2.436094 -1.673006 0.406542
N 3.586938 -2.499704 -0.394423
N -3.586829 -2.500643 0.387556
C 1.161710 0.408280 0.010502
C -1.161547 0.408368 -0.009100
C 1.206401 1.815680 0.019155
C -1.206183 1.815811 -0.013633
C 0.000121 2.520691 0.003793
C 2.464687 -0.354689 0.034616
C -2.464548 -0.354488 -0.035518
H 2.173282 2.328280 0.044710
H -2.173040 2.328515 -0.037714
H 0.000170 3.612722 0.005383
H 1.575517 -2.183441 -0.630129
H -1.575566 -2.184828 0.624875
H 4.280421 -2.128357 -1.061558
H 4.043830 -2.455156 0.529584
H -4.279185 -2.134101 1.058500
H -4.045419 -2.449876 -0.535293


%chk=000225358-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225358

0 1
O 3.601480 0.263356 -0.113559
O -3.601399 0.263349 0.114240
N 0.000033 -0.252403 -0.000059
N 2.320350 -1.689509 -0.106112
N -2.320372 -1.689552 0.102771
N 3.417503 -2.589519 -0.113452
N -3.417668 -2.589408 0.106289
C 1.170908 0.452981 -0.038983
C -1.170780 0.452983 0.040748
C 1.215769 1.867044 -0.040208
C -1.215513 1.867042 0.045703
C 0.000160 2.583246 0.003695
C 2.471238 -0.317563 -0.091173
C -2.471159 -0.317572 0.090996
H 2.193222 2.355751 -0.074355
H -2.192923 2.355746 0.081112
H 0.000210 3.677690 0.005132
H 1.381846 -2.091056 -0.051993
H -1.381937 -2.091028 0.046851
H 3.911492 -2.549097 -1.016924
H 4.064459 -2.365727 0.656765
H -3.909783 -2.555171 1.011043
H -4.066138 -2.360085 -0.661028


