%chk=000257968.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257968

0 1
O 5.064146 -0.792236 -0.736826
O 5.064289 0.788779 0.739223
N -4.051994 0.001073 -0.000958
N 4.498490 -0.001546 0.001058
C -1.246621 0.000213 -0.000292
C 0.236707 -0.000240 0.000061
C -1.949034 -1.157877 0.350490
C -1.948161 1.158738 -0.351406
C -3.358804 -1.121641 0.342726
C -3.357949 1.123368 -0.344316
C 0.936981 -0.887296 -0.834870
C 0.937128 0.886378 0.835323
C 3.019493 -0.001091 0.000716
C 2.330796 -0.889907 -0.839655
C 2.330948 0.888133 0.840768
C -4.159465 -2.324913 0.713880
C -4.157708 2.327122 -0.715850
H -1.424545 -2.066477 0.631618
H -1.422973 2.067014 -0.632273
H 0.387558 -1.571419 -1.484008
H 0.387828 1.570836 1.484213
H 2.892158 -1.573274 -1.486836
H 2.892414 1.571144 1.488233
H -5.244458 -2.131482 0.654934
H -3.945917 -3.171103 0.045696
H -3.944867 -2.647076 1.742837
H -3.943976 3.173178 -0.047555
H -3.942419 2.649163 -1.744700
H -5.242846 2.134340 -0.657433


%chk=000257968-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257968

0 1
O 5.155856 -1.054764 -0.438271
O 5.156287 1.051299 0.440648
N -4.096997 0.001086 -0.000966
N 4.549549 -0.001542 0.001030
C -1.243916 0.000198 -0.000269
C 0.245588 -0.000258 0.000080
C -1.981988 -1.194431 0.205031
C -1.981145 1.195287 -0.205924
C -3.397881 -1.161473 0.198792
C -3.397061 1.163211 -0.200376
C 0.974624 -1.126748 -0.476753
C 0.975086 1.125792 0.477241
C 3.067922 -0.001104 0.000706
C 2.380377 -1.136756 -0.480705
C 2.380843 1.134958 0.481816
C -4.215618 -2.417844 0.419506
C -4.213907 2.420091 -0.421494
H -1.469482 -2.142236 0.400572
H -1.467952 2.142774 -0.401208
H 0.433766 -1.990514 -0.876255
H 0.434569 1.989881 0.876504
H 2.950530 -1.991930 -0.852510
H 2.951343 1.989791 0.853873
H -5.287023 -2.170941 0.370901
H -3.992483 -3.183591 -0.346625
H -4.000005 -2.868794 1.406116
H -3.990714 3.185677 0.344782
H -3.997481 2.870937 -1.407973
H -5.285490 2.173846 -0.373471


