%chk=000286682.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286682

0 1
O -2.325140 0.274986 1.177911
O -1.920024 -2.750326 -0.503599
O -3.641166 -0.359018 -1.993625
O -4.113377 2.672151 0.453933
O 4.088794 -0.834005 -0.279791
N 0.200919 1.274034 0.724905
N 1.478614 1.588609 0.488789
N 1.428325 -2.044534 -0.043295
N 4.320428 1.424941 -0.173224
N 5.709476 1.405978 -0.453107
C -1.893931 -1.326647 -0.587021
C -1.375169 -0.735629 0.751336
C -3.366977 -0.859744 -0.683952
C -3.483874 0.330152 0.294951
C -0.043066 -0.099679 0.600554
C -3.489444 1.702930 -0.390472
C 1.194110 -0.690597 0.273608
C 2.127983 0.406404 0.210116
C 3.559902 0.262084 -0.096420
H -1.296850 -1.003739 -1.467241
H -1.377109 -1.501766 1.564110
H -4.067065 -1.689893 -0.442549
H -4.347411 0.228824 0.991283
H -4.132132 1.703242 -1.299229
H -2.472378 2.032769 -0.660186
H -1.033737 -3.112993 -0.746534
H -3.773234 -1.105382 -2.620169
H -0.493600 1.970636 0.972447
H -3.625935 2.753801 1.300771
H 1.170273 -2.678995 0.709844
H 2.410804 -2.212190 -0.310313
H 3.949093 2.366657 -0.020495
H 6.194242 0.812091 0.236932
H 5.871256 0.952545 -1.365368


%chk=000286682-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000286682

0 1
O -2.314426 0.646829 0.991768
O -1.403413 -2.361648 -0.962522
O -4.103202 -0.912351 -1.774918
O -4.145525 2.742049 0.301170
O 4.019978 -0.979828 -0.624976
N 0.418442 1.323417 0.961897
N 1.754174 1.567492 0.720380
N 1.289346 -1.994597 -0.205298
N 4.486711 1.198305 0.092727
N 5.858818 1.176279 -0.264236
C -1.846015 -1.014908 -0.671288
C -1.382727 -0.468171 0.707318
C -3.376090 -0.965139 -0.511398
C -3.627736 0.338033 0.292268
C 0.030146 0.027452 0.678713
C -3.987590 1.561963 -0.555979
C 1.192410 -0.640882 0.251094
C 2.228537 0.348047 0.286145
C 3.634392 0.131211 -0.116402
H -1.535917 -0.298285 -1.462396
H -1.511801 -1.270693 1.466092
H -3.680656 -1.855215 0.077984
H -4.380631 0.208380 1.089523
H -4.959798 1.409882 -1.047773
H -3.216973 1.727815 -1.335856
H -0.386089 -2.349603 -0.987962
H -3.885021 -1.733563 -2.284869
H -0.196111 2.074860 1.270821
H -3.321923 2.827035 0.847242
H 1.111230 -2.694282 0.528225
H 2.212003 -2.145057 -0.647819
H 4.121459 2.071809 0.480322
H 6.368199 0.477606 0.294928
H 5.968402 0.983453 -1.270027


