%chk=000250562.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250562

0 1
O -2.302898 -1.879827 -0.000020
O -4.323482 2.134438 0.000290
N -0.959894 0.018137 -0.000187
N 1.304906 1.627042 -0.000073
N -3.384862 0.159648 0.000080
N -3.308574 1.510565 0.000051
C 1.485149 0.247516 -0.000038
C 0.318291 -0.619652 -0.000099
C 2.779628 -0.339454 0.000053
C 0.490249 -1.990141 -0.000064
C 2.914593 -1.759816 0.000084
C 1.794463 -2.553634 0.000025
C 3.910654 0.541017 0.000110
C 3.719192 1.898075 0.000074
C -2.176407 -0.669843 -0.000284
C 2.378607 2.408911 -0.000019
C -4.686579 -0.568087 0.000524
H -0.371963 -2.668980 -0.000115
H 3.912469 -2.194189 0.000154
H -0.946796 1.055668 -0.000145
H 1.882201 -3.641696 0.000044
H 4.911945 0.108904 0.000180
H 4.553445 2.596255 0.000114
H 2.206024 3.493121 -0.000049
H -5.272631 -0.299015 0.895582
H -4.529662 -1.663214 0.000548
H -5.273167 -0.299145 -0.894222


%chk=000250562-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250562

0 1
O -2.391422 -2.033288 -0.000031
O -4.025556 2.260769 0.000553
N -0.947355 -0.166496 -0.000423
N 1.121159 1.495150 -0.000177
N -3.291780 0.139729 0.000016
N -2.993457 1.506150 0.000064
C 1.428632 0.144236 -0.000096
C 0.319230 -0.783151 -0.000219
C 2.781276 -0.355522 0.000097
C 0.565681 -2.164941 -0.000148
C 3.004602 -1.769992 0.000167
C 1.912233 -2.641643 0.000044
C 3.831566 0.620361 0.000207
C 3.514520 1.981167 0.000124
C -2.171133 -0.790474 -0.000550
C 2.138563 2.375783 -0.000070
C -4.678933 -0.352408 0.000612
H -0.273768 -2.862848 -0.000247
H 4.030602 -2.154740 0.000315
H -0.906852 0.869788 -0.000418
H 2.080529 -3.724019 0.000095
H 4.875301 0.285786 0.000354
H 4.295266 2.747510 0.000203
H 1.865024 3.436900 -0.000138
H -5.209206 0.019499 0.894149
H -4.639806 -1.450354 0.000493
H -5.210016 0.019654 -0.892378


