%chk=000276813.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276813

0 1
O 2.758678 -3.162440 -0.000081
O -1.787512 -1.581976 0.000022
O -6.576817 -0.236648 0.000040
O -5.680574 1.818365 0.000037
N -0.626759 0.415936 0.000076
N 1.460748 2.246433 0.000175
C 1.782258 0.893297 0.000112
C 3.131362 0.435379 0.000098
C 0.706476 -0.083877 0.000059
C 3.417195 -0.949190 0.000031
C 1.002008 -1.433199 -0.000005
C 2.360592 -1.850156 -0.000018
C 4.167296 1.433514 0.000153
C 3.835541 2.760355 0.000216
C 2.446807 3.132859 0.000225
C -1.798041 -0.365063 0.000052
C 1.737501 -4.192885 -0.000139
C -3.058257 0.449492 0.000119
C -4.245847 -0.160595 -0.000048
C -5.504705 0.622593 0.000017
H 4.443331 -1.306524 0.000019
H 0.198019 -2.176776 -0.000044
H 5.206623 1.104137 0.000142
H -0.707305 1.446906 0.000111
H 4.592128 3.542300 0.000258
H 2.168585 4.193465 0.000275
H 2.346153 -5.106463 -0.000186
H 1.128381 -4.124448 -0.906602
H 1.128377 -4.124544 0.906329
H -2.966370 1.541828 0.000310
H -4.358971 -1.255783 -0.000235
H -7.451600 0.242410 0.000083


%chk=000276813-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000276813

0 1
O 2.883121 -3.237265 -0.000076
O -1.847362 -1.693122 -0.000052
O -6.629776 -0.010876 0.000033
O -5.493457 2.022761 0.000119
N -0.603916 0.302404 0.000044
N 1.309140 2.150155 0.000161
C 1.732626 0.832908 0.000105
C 3.121572 0.442885 0.000109
C 0.711710 -0.189968 0.000039
C 3.465990 -0.938416 0.000047
C 1.064701 -1.547800 -0.000021
C 2.449976 -1.907847 -0.000017
C 4.085201 1.508057 0.000177
C 3.651396 2.835587 0.000234
C 2.247171 3.116550 0.000224
C -1.793489 -0.420190 -0.000007
C 1.867496 -4.299542 -0.000150
C -3.008620 0.445754 0.000047
C -4.258561 -0.094938 0.000049
C -5.460751 0.766868 0.000104
H 4.511874 -1.259908 0.000048
H 0.266410 -2.291524 -0.000069
H 5.153812 1.265646 0.000183
H -0.616304 1.337249 0.000096
H 4.364856 3.665130 0.000286
H 1.886864 4.151175 0.000268
H 2.441164 -5.237570 -0.000189
H 1.232263 -4.247750 -0.904163
H 1.232230 -4.247844 0.903844
H -2.894811 1.538578 0.000085
H -4.395483 -1.180974 0.000008
H -7.421740 0.592532 0.000035


