%chk=000299605.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299605

0 1
O 2.318027 1.524350 0.319726
O 5.046736 -1.592628 -1.018713
N 0.791399 -0.244130 0.377131
N 3.097020 -0.594045 0.842574
C -2.993869 -2.376771 0.489076
C -4.057315 -1.798826 -0.448393
C -1.620028 -1.775675 0.165688
C -4.169046 -0.283389 -0.250923
C -1.638382 -0.272828 0.058996
C -2.837861 0.418444 -0.176096
C -0.430601 0.474539 0.151217
C -2.835525 1.818071 -0.319277
C -0.438180 1.868941 0.008576
C -1.643465 2.531417 -0.229321
C 2.078018 0.338474 0.475175
C 4.494596 -0.108132 0.726227
C 5.027141 -0.181993 -0.711569
H -2.955621 -3.477897 0.399148
H -3.261144 -2.160882 1.542144
H -5.036718 -2.278155 -0.265519
H -3.795955 -2.023462 -1.501028
H -1.255236 -2.188758 -0.800489
H -0.896416 -2.106263 0.940755
H -4.725359 -0.068952 0.687767
H -4.781233 0.150959 -1.067838
H -3.768450 2.345739 -0.500941
H 0.492367 2.442563 0.080902
H -1.644972 3.615335 -0.342753
H 0.679639 -1.225435 0.653122
H 3.000962 -1.565048 0.528232
H 5.117759 -0.746032 1.396602
H 4.556494 0.943133 1.098789
H 6.053378 0.218023 -0.786751
H 4.367819 0.338369 -1.429954
H 5.341819 -1.732255 -1.938181


%chk=000299605-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299605

0 1
O 2.271622 1.812591 0.446363
O 5.062367 -2.034889 -0.618636
N 0.755018 -0.004416 0.262837
N 3.055168 -0.387452 0.393074
C -2.879900 -2.438215 0.352943
C -3.973688 -1.839923 -0.554062
C -1.538065 -1.692785 0.163558
C -4.228088 -0.374521 -0.146716
C -1.675731 -0.169406 0.096882
C -2.945103 0.450123 -0.052209
C -0.502951 0.655193 0.160513
C -3.036321 1.863537 -0.111665
C -0.606368 2.068407 0.112810
C -1.878552 2.660534 -0.020749
C 2.036455 0.567091 0.370341
C 4.463066 -0.001294 0.498431
C 5.270829 -0.570652 -0.670270
H -2.735756 -3.515330 0.145042
H -3.205790 -2.351595 1.408714
H -4.908739 -2.425721 -0.473293
H -3.645372 -1.887818 -1.611806
H -1.055456 -2.059031 -0.770075
H -0.866622 -1.982351 1.001229
H -4.741047 -0.362860 0.838200
H -4.920756 0.112199 -0.859600
H -4.021040 2.331671 -0.231491
H 0.301157 2.670305 0.180067
H -1.958092 3.752725 -0.062080
H 0.713193 -1.024048 0.277798
H 2.880946 -1.378381 0.213643
H 4.895860 -0.371185 1.448655
H 4.503386 1.101546 0.500925
H 6.344055 -0.318648 -0.545299
H 4.899754 -0.156087 -1.629702
H 5.548357 -2.472516 -1.360272


