%chk=000256827.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256827

0 1
O 4.297250 0.828111 -0.494125
N 3.144478 -0.951077 0.328446
N 4.077121 -1.202948 1.370642
C 0.803900 0.380296 -0.899416
C -1.409362 -0.568835 -0.535202
C -1.735895 0.511215 0.325376
C -0.115134 -0.614234 -1.142857
C 2.164557 0.352854 -1.532526
C 0.473804 1.469988 -0.032354
C -0.759699 1.531804 0.561698
C -2.384263 -1.589663 -0.774030
C -3.030112 0.553869 0.933887
C -3.618333 -1.523503 -0.177177
C -3.945926 -0.438393 0.687969
C 3.284739 0.148762 -0.532880
H 0.117489 -1.448218 -1.802929
H 2.352418 1.312969 -2.071890
H 2.236822 -0.426894 -2.322643
H 1.219314 2.245700 0.143194
H -1.018599 2.358740 1.223234
H -2.126736 -2.414570 -1.436422
H -3.270909 1.386902 1.593026
H -4.366296 -2.295642 -0.353204
H -4.933348 -0.414608 1.146562
H 2.246681 -1.414477 0.494837
H 4.934163 -1.595324 0.953558
H 4.369877 -0.317424 1.811429


%chk=000256827-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256827

0 1
O 4.587957 0.092592 -1.045470
N 3.046915 -0.615113 0.541870
N 4.019738 -1.126309 1.444973
C 0.826606 0.436825 -0.906642
C -1.399892 -0.584574 -0.545861
C -1.758584 0.498194 0.348375
C -0.101624 -0.582451 -1.155577
C 2.202491 0.433240 -1.550008
C 0.456751 1.506517 -0.017395
C -0.797778 1.535992 0.590602
C -2.357547 -1.622797 -0.796666
C -3.057417 0.500905 0.955431
C -3.615901 -1.594505 -0.190604
C -3.969326 -0.524284 0.692816
C 3.384204 -0.031341 -0.669336
H 0.160113 -1.402082 -1.837566
H 2.478377 1.444660 -1.900777
H 2.216431 -0.216785 -2.444668
H 1.178050 2.310435 0.172951
H -1.066412 2.360727 1.261559
H -2.087582 -2.442010 -1.473916
H -3.325821 1.322092 1.630858
H -4.340144 -2.392152 -0.388928
H -4.959736 -0.514915 1.160819
H 2.072242 -0.707179 0.833792
H 4.583006 -1.853991 0.981115
H 4.632884 -0.366291 1.774456


