%chk=000201997.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201997

0 1
O 0.748016 2.634672 0.000037
N 0.877323 -1.453777 0.000121
N -1.483644 -1.655300 0.000089
N 1.990552 0.709586 0.000091
N 3.263495 -1.264253 0.000036
C -0.475596 0.586563 0.000092
C -0.387376 -0.825994 0.000119
C -1.756255 1.159655 0.000041
C 0.759809 1.426352 0.000202
C 2.038856 -0.615225 0.000058
C -2.878979 0.334223 -0.000027
C -2.701459 -1.063299 -0.000020
H 0.919677 -2.473457 0.000274
H -1.848978 2.251684 0.000076
H -3.880803 0.757543 -0.000107
H -3.561248 -1.747516 0.000026
H 4.108456 -0.704691 -0.000138
H 3.354552 -2.261366 -0.000069


%chk=000201997-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201997

0 1
O 0.750063 2.680981 -0.000086
N 0.878899 -1.424954 0.000126
N -1.461810 -1.666717 0.000073
N 2.015935 0.706327 0.000077
N 3.238949 -1.278315 0.000014
C -0.463339 0.592984 0.000122
C -0.388873 -0.827268 0.000119
C -1.754508 1.168190 0.000056
C 0.793524 1.416010 0.000221
C 2.025702 -0.625630 0.000071
C -2.886196 0.326123 0.000010
C -2.691045 -1.078568 0.000023
H 0.902987 -2.447863 0.000133
H -1.831556 2.260407 0.000059
H -3.900399 0.735065 -0.000033
H -3.544751 -1.764951 -0.000021
H 4.066799 -0.686331 -0.000021
H 3.336015 -2.290089 -0.000042


