%chk=000280876.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280876

0 1
O -0.287334 -2.072384 1.202679
O -6.096592 0.305450 0.249302
N 1.090591 -2.171284 1.233879
C 0.532455 -0.153100 0.310818
C -0.629198 -0.828764 0.630686
C 1.614298 -1.048472 0.717601
C 0.683274 1.162587 -0.300196
C -2.051069 -0.571916 0.530446
C 3.057904 -0.815938 0.595705
C 0.024525 1.459731 -1.505952
C 1.486357 2.138551 0.314183
C -2.533271 0.755921 0.503791
C -2.958582 -1.644266 0.470025
C 3.917921 -1.186311 1.643088
C 3.581935 -0.234547 -0.570552
C -3.893341 1.006641 0.408722
C -4.330825 -1.413535 0.373775
C -4.785535 -0.087410 0.343324
C 0.168250 2.721977 -2.085974
C 1.623675 3.398434 -0.272763
C 0.965821 3.692989 -1.471493
C 5.292389 -0.966218 1.523921
C 4.957582 -0.020111 -0.681325
C 5.813217 -0.383208 0.364268
C -7.115182 -0.724025 0.186466
H -0.594513 0.702893 -1.985982
H 2.002814 1.906722 1.245285
H -1.827009 1.589197 0.560408
H -2.581296 -2.670381 0.499584
H 3.511067 -1.650020 2.542806
H 2.914802 0.048902 -1.385679
H -4.288278 2.020689 0.386006
H -5.018221 -2.251676 0.326302
H -0.342156 2.949371 -3.020707
H 2.246376 4.153045 0.205725
H 1.075326 4.675522 -1.925932
H 5.958590 -1.253208 2.336080
H 5.363559 0.430479 -1.585700
H 6.884855 -0.213993 0.274142
H -8.033312 -0.124498 0.122747
H -7.103308 -1.326395 1.099355
H -6.982861 -1.334943 -0.710963


%chk=000280876-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000280876

0 1
O -0.279413 -2.058344 1.140981
O -6.211370 0.284896 0.240200
N 1.172509 -2.171239 1.204414
C 0.553780 -0.124891 0.263078
C -0.622319 -0.818105 0.568394
C 1.634576 -1.001987 0.681778
C 0.682151 1.222073 -0.350596
C -2.058010 -0.544470 0.471851
C 3.101075 -0.809797 0.592908
C 0.169567 1.478958 -1.651088
C 1.329551 2.276282 0.348489
C -2.564519 0.778362 0.303360
C -2.987988 -1.614453 0.577120
C 3.944909 -1.421979 1.560309
C 3.691614 -0.061202 -0.460274
C -3.944637 1.014507 0.230701
C -4.376465 -1.387631 0.505852
C -4.859549 -0.065935 0.328006
C 0.295974 2.758640 -2.235072
C 1.457375 3.555364 -0.236492
C 0.940275 3.802276 -1.529782
C 5.345544 -1.281778 1.479348
C 5.094013 0.079399 -0.535790
C 5.926665 -0.527095 0.432709
C -7.204690 -0.788258 0.351246
H -0.324954 0.670463 -2.201300
H 1.729231 2.088436 1.351036
H -1.875854 1.624802 0.239289
H -2.613364 -2.633009 0.717569
H 3.489098 -2.005601 2.366591
H 3.059994 0.399770 -1.225317
H -4.340116 2.026854 0.106570
H -5.062440 -2.235509 0.589078
H -0.104046 2.939429 -3.239046
H 1.958075 4.357434 0.317124
H 1.039597 4.794772 -1.983228
H 5.983246 -1.758216 2.232167
H 5.535478 0.657927 -1.354787
H 7.014994 -0.415186 0.371847
H -8.178681 -0.286469 0.258472
H -7.137800 -1.296792 1.332317
H -7.087375 -1.530201 -0.462132


