%chk=000289994.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289994

0 1
O 1.303871 2.656007 0.340469
O 1.303558 -2.655995 -0.340530
N 0.130796 1.097727 -0.855174
N 0.130747 -1.097770 0.855425
C -2.168210 0.739161 0.039328
C -2.168206 -0.739103 -0.039319
C -1.151074 1.603566 -0.424633
C -1.151123 -1.603525 0.424753
C 2.505923 0.681820 -0.163713
C 2.505921 -0.682065 0.163941
C -3.329328 1.333601 0.578270
C -3.329301 -1.333534 -0.578323
C 1.288960 1.563110 -0.197946
C 1.288930 -1.563323 0.198346
C -1.329953 3.000838 -0.410102
C -1.330047 -3.000789 0.410262
C -3.498046 2.716119 0.613211
C -3.498052 -2.716048 -0.613228
C 3.728649 1.350775 -0.341698
C 3.728646 -1.351044 0.341839
C -2.501467 3.553319 0.100489
C -2.501536 -3.553257 -0.100401
C 4.940218 0.675406 -0.178757
C 4.940217 -0.675700 0.178805
H 0.133104 0.227783 -1.387687
H 0.133081 -0.227772 1.387856
H -4.112563 0.692697 0.988366
H -4.112496 -0.692624 -0.988486
H -0.527534 3.648963 -0.774040
H -0.527670 -3.648918 0.774284
H -4.403976 3.143872 1.039820
H -4.403966 -3.143790 -1.039884
H 3.723695 2.416802 -0.589582
H 3.723688 -2.417066 0.589742
H -2.633504 4.634866 0.110844
H -2.633602 -4.634800 -0.110726
H 5.882575 1.205208 -0.322368
H 5.882574 -1.205519 0.322350


%chk=000289994-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000289994

0 1
O 1.442573 2.811673 0.233993
O 1.442533 -2.811803 -0.233881
N 0.142445 1.134517 -0.756385
N 0.142396 -1.134592 0.756404
C -2.197862 0.754447 0.031806
C -2.197900 -0.754435 -0.031737
C -1.147472 1.644794 -0.378882
C -1.147546 -1.644827 0.378935
C 2.538869 0.702934 -0.142347
C 2.538829 -0.703052 0.142402
C -3.405335 1.362959 0.490828
C -3.405407 -1.362894 -0.490741
C 1.339984 1.630710 -0.220053
C 1.339899 -1.630777 0.219991
C -1.339901 3.050461 -0.358720
C -1.340032 -3.050487 0.358773
C -3.588155 2.757614 0.532646
C -3.588287 -2.757542 -0.532556
C 3.787048 1.374604 -0.267271
C 3.786969 -1.374775 0.267429
C -2.551019 3.608221 0.091093
C -2.551181 -3.608194 -0.091020
C 5.010490 0.694166 -0.135376
C 5.010450 -0.694390 0.135635
H 0.164391 0.211221 -1.192453
H 0.164375 -0.211305 1.192487
H -4.204232 0.711378 0.859518
H -4.204280 -0.711278 -0.859420
H -0.522181 3.692155 -0.688230
H -0.522334 -3.692216 0.688270
H -4.528360 3.173161 0.910159
H -4.528516 -3.173047 -0.910056
H 3.764349 2.452356 -0.454448
H 3.764208 -2.452528 0.454599
H -2.677115 4.695844 0.100896
H -2.677325 -4.695812 -0.100821
H 5.954101 1.239359 -0.242567
H 5.954030 -1.239623 0.242903


