%chk=000242588.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242588

0 1
O 0.554468 -0.678316 0.051997
O -3.744836 1.705818 -0.519281
O -3.711597 -2.778079 0.207296
O -1.000466 3.088007 0.148521
N 5.479748 -0.738440 -0.170928
C -1.448392 0.753954 -0.113214
C -0.828397 -0.513309 0.015199
C -2.869021 0.715540 -0.243112
C 1.364719 0.451520 -0.041844
C -0.602097 1.948773 -0.011763
C -1.488508 -1.732801 0.124237
C 0.854499 1.689818 -0.081434
C -2.895041 -1.693835 0.085482
C -3.583603 -0.493759 -0.111641
C 2.780835 0.033704 -0.079987
C 3.757815 0.803541 0.567643
C 3.161370 -1.127760 -0.767220
C 5.095707 0.380708 0.495103
C 4.521851 -1.476432 -0.788592
C -3.343355 3.046302 -0.904411
C -3.101139 -4.080169 0.411898
H -0.925451 -2.651098 0.236542
H 1.478973 2.581825 -0.152693
H -4.671788 -0.485287 -0.177472
H 3.490836 1.704183 1.119018
H 2.415618 -1.745550 -1.267468
H 5.897076 0.949436 0.983930
H 4.869662 -2.374508 -1.314507
H -4.285328 3.443733 -1.301724
H -2.559317 3.020671 -1.664195
H -3.012092 3.594711 -0.010414
H -2.527902 -4.087314 1.343631
H -2.486813 -4.348959 -0.452099
H -3.985136 -4.728131 0.486404


%chk=000242588-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242588

0 1
O 0.558504 -0.704526 -0.043158
O -3.698196 1.916509 0.032991
O -3.804068 -2.787797 0.041162
O -0.967987 3.129214 0.501783
N 5.599895 -0.712626 -0.154147
C -1.444981 0.766518 0.041124
C -0.842869 -0.530443 -0.011788
C -2.892816 0.781146 0.019727
C 1.405268 0.407328 0.039576
C -0.561802 1.942240 0.248397
C -1.554592 -1.742680 -0.020179
C 0.880859 1.666830 0.184859
C -2.964245 -1.676129 0.029248
C -3.620415 -0.422703 0.034919
C 2.833820 0.031858 -0.027393
C 3.864057 1.009923 0.014069
C 3.227611 -1.328702 -0.135786
C 5.209605 0.595042 -0.050978
C 4.601755 -1.645373 -0.194711
C -3.456560 3.025764 -0.918009
C -3.182168 -4.117174 0.006277
H -0.997392 -2.680482 -0.052716
H 1.534974 2.535037 0.287807
H -4.711658 -0.380721 0.026957
H 3.636981 2.076864 0.094079
H 2.474292 -2.118753 -0.171759
H 6.019976 1.331582 -0.020224
H 4.929091 -2.687698 -0.277454
H -4.411644 3.572252 -0.945842
H -3.220980 2.624966 -1.922225
H -2.638452 3.662943 -0.548940
H -2.536676 -4.277956 0.890606
H -2.593769 -4.258332 -0.920403
H -4.022521 -4.825427 0.025033


