%chk=000234088.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234088

0 1
O 4.245313 -1.701334 -0.001911
O -4.946312 0.486404 0.001266
N 1.191532 2.529851 0.000726
N 1.934670 -1.666722 -0.001429
N -3.189306 -1.012326 0.001191
C 0.337309 0.211191 0.000092
C 0.142362 1.619122 0.000785
C 1.710188 -0.259453 -0.000712
C -0.802244 -0.643502 0.000217
C -2.080055 -0.106584 0.001022
C 2.740370 0.656519 -0.000765
C 2.442336 2.058665 -0.000019
C -1.193489 2.149174 0.001594
C -2.275152 1.313952 0.001711
C 3.563689 3.045028 -0.000068
C 3.198945 -2.312063 -0.002069
C -4.561858 -0.663756 0.001372
C 3.100822 -3.812396 -0.002976
C -5.481311 -1.853736 0.001695
H -0.652035 -1.720274 -0.000325
H 3.788805 0.339683 -0.001342
H -1.310603 3.236756 0.002105
H -3.296883 1.717116 0.002303
H 1.091644 -2.248822 -0.001603
H -2.944408 -2.003745 0.001168
H 3.198208 4.085204 0.000521
H 4.201404 2.921388 0.887105
H 4.200678 2.922138 -0.887865
H 2.589844 -4.203862 0.886409
H 4.115284 -4.249305 -0.002746
H 2.590758 -4.202705 -0.893420
H -5.357634 -2.484813 -0.888052
H -6.530862 -1.509568 0.002057
H -5.357012 -2.484828 0.891361


%chk=000234088-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234088

0 1
O 4.299303 -1.778991 -0.002157
O -5.060556 0.465915 0.002225
N 1.213502 2.580785 0.000642
N 1.950027 -1.646659 -0.001354
N -3.199152 -0.973508 0.001132
C 0.352895 0.231389 0.000089
C 0.167253 1.667360 0.000698
C 1.724765 -0.247039 -0.000658
C -0.802217 -0.607331 0.000262
C -2.101548 -0.066389 0.000981
C 2.767441 0.688675 -0.000685
C 2.472885 2.092874 -0.000015
C -1.165560 2.186259 0.001411
C -2.284361 1.356881 0.001556
C 3.609436 3.093472 -0.000041
C 3.169352 -2.342178 -0.002123
C -4.574046 -0.700320 0.001746
C 3.003000 -3.862280 -0.002927
C -5.443614 -1.958754 0.001597
H -0.708467 -1.703201 -0.000125
H 3.803000 0.346853 -0.001219
H -1.271658 3.275174 0.001850
H -3.297992 1.759772 0.002105
H 1.116170 -2.235562 -0.001365
H -2.947620 -1.965263 0.000722
H 3.203168 4.116311 0.000480
H 4.254513 2.962698 0.888917
H 4.253899 2.963358 -0.889541
H 2.453711 -4.207909 0.892547
H 4.001028 -4.322544 -0.002560
H 2.454853 -4.206963 -0.899468
H -5.255084 -2.578495 -0.894695
H -6.499139 -1.652639 0.002266
H -5.254188 -2.579355 0.897105


