%chk=000261476.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261476

0 1
O 2.784325 -1.376676 -0.982650
O -3.114113 -1.225104 -0.598868
O 2.176293 -0.909990 1.188142
O -1.631287 -1.626430 1.114883
N 1.048301 0.008779 -0.639603
N -1.364198 0.161094 -0.369843
N 0.078954 4.260280 1.195312
C -0.053621 0.621122 0.148556
C 0.004819 2.131510 0.031791
C 0.039196 2.795462 -1.201451
C 0.029738 2.905549 1.211209
C 2.006109 -0.786696 -0.004633
C -1.982263 -0.977756 0.155234
C 0.092143 4.191075 -1.227355
C 0.109457 4.889386 -0.008496
C 3.869852 -2.246191 -0.515052
C -3.931809 -2.373971 -0.193872
C 3.305950 -3.553409 -0.004187
C -3.249275 -3.665177 -0.587389
H 0.056492 0.278459 1.229239
H 1.008694 0.028619 -1.655582
H -1.770756 0.619987 -1.182879
H 0.030914 2.235176 -2.135797
H 0.012327 2.436839 2.205173
H 0.122236 4.729450 -2.172032
H 0.149971 5.985162 0.022863
H 4.450614 -2.351031 -1.450164
H 4.446732 -1.699888 0.252389
H -4.118452 -2.302195 0.892539
H -4.853033 -2.168049 -0.770267
H 4.100680 -4.271688 0.228394
H 2.722235 -3.399582 0.918848
H 2.632951 -4.020059 -0.734496
H -3.902459 -4.530764 -0.424559
H -2.951802 -3.663207 -1.643577
H -2.335414 -3.827789 0.007079


%chk=000261476-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000261476

0 1
O 2.712302 -1.381316 -1.216501
O -3.266399 -1.247020 -0.222451
O 2.338343 -0.623981 0.991335
O -1.402390 -1.745299 1.143696
N 0.903646 -0.076714 -0.788294
N -1.460082 0.123351 -0.281916
N -1.140680 4.299661 0.336658
C -0.113049 0.602339 0.033705
C -0.061043 2.132403 -0.088817
C 1.079184 2.795501 -0.599404
C -1.137332 2.934898 0.374244
C 2.003048 -0.691567 -0.217834
C -1.978618 -1.025174 0.292382
C 1.094546 4.206618 -0.645248
C -0.032620 4.915993 -0.172567
C 3.902701 -2.144954 -0.739362
C -3.961188 -2.465623 0.288167
C 3.492414 -3.519830 -0.205183
C -3.563359 -3.703693 -0.519679
H 0.123614 0.308907 1.075933
H 0.732583 -0.219217 -1.785040
H -2.039831 0.629034 -0.953533
H 1.935177 2.211535 -0.951515
H -2.034098 2.471225 0.802228
H 1.962104 4.747950 -1.035159
H -0.061242 6.011259 -0.191410
H 4.537718 -2.219324 -1.636945
H 4.412011 -1.549841 0.039240
H -3.713194 -2.588226 1.357164
H -5.029013 -2.220006 0.172285
H 4.394268 -4.097498 0.071386
H 2.861311 -3.414763 0.693056
H 2.936884 -4.090416 -0.969464
H -4.154749 -4.575026 -0.181488
H -3.757365 -3.551980 -1.595684
H -2.495099 -3.936911 -0.375085


