%chk=000244651.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244651

0 1
O 0.704684 -0.588824 -1.608557
O -0.699907 -0.592401 1.607369
N 1.768048 -0.587913 0.478017
N -1.763274 -0.593092 -0.479205
N 3.039579 -0.585709 -0.054014
N -3.034803 -0.595393 0.052827
C 5.430979 -0.583370 0.206621
C -5.426188 -0.600228 -0.207780
C 6.468546 -0.620271 1.064405
C -6.463667 -0.638607 -1.065602
C 5.563633 -0.540302 -1.279427
C -5.558920 -0.560150 1.278341
C 4.055710 -0.585127 0.764459
C -4.050933 -0.597244 -0.765648
C 7.903990 -0.624228 0.670458
C -7.899079 -0.647466 -0.671623
C 0.678485 -0.589284 -0.400111
C -0.673711 -0.591756 0.398923
H 6.306847 -0.651047 2.144107
H -6.301911 -0.667114 -2.145357
H 5.080027 0.358286 -1.693737
H 5.058299 -1.400736 -1.746346
H 6.609687 -0.543387 -1.612441
H -5.053660 -1.421588 1.743459
H -5.075274 0.337535 1.694591
H -6.604993 -0.563838 1.611294
H 3.994305 -0.586437 1.864865
H -3.989540 -0.597268 -1.866043
H 8.428912 0.247078 1.088493
H 8.049689 -0.598668 -0.420318
H 8.412225 -1.524827 1.044680
H -8.403238 -1.551667 -1.042717
H -8.044888 -0.618834 0.419062
H -8.427935 0.219984 -1.092660
H 1.596229 -0.588629 1.499263
H -1.591453 -0.592381 -1.500450


%chk=000244651-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244651

0 1
O 0.535665 -0.596507 -1.722039
O -0.530853 -0.600352 1.720880
N 1.770702 -0.595598 0.308500
N -1.765890 -0.600896 -0.309659
N 3.034717 -0.592418 -0.262595
N -3.029908 -0.602417 0.261437
C 5.430472 -0.587576 0.089831
C -5.425667 -0.604439 -0.090986
C 6.433945 -0.586624 1.031544
C -6.429141 -0.605162 -1.032699
C 5.630213 -0.585321 -1.411547
C -5.625410 -0.604986 1.410393
C 4.050644 -0.590931 0.582900
C -4.045836 -0.602950 -0.584057
C 7.922151 -0.583108 0.801663
C -7.917350 -0.606595 -0.802817
C 0.625381 -0.597557 -0.458758
C -0.620567 -0.600174 0.457598
H 6.128788 -0.588410 2.090953
H -6.123982 -0.604611 -2.092109
H 5.141128 0.296663 -1.862641
H 5.141663 -1.466253 -1.865214
H 6.694569 -0.584486 -1.693991
H -5.136358 -1.486470 1.862482
H -5.136828 0.276448 1.863067
H -6.689766 -0.605381 1.692836
H 3.907233 -0.592431 1.683558
H -3.902424 -0.602524 -1.684715
H 8.386829 0.305750 1.272942
H 8.196044 -0.584397 -0.265484
H 8.391564 -1.467523 1.276491
H -8.383546 -1.493673 -1.275896
H -8.191238 -0.606892 0.264332
H -8.385253 0.279608 -1.275847
H 1.610937 -0.596614 1.333789
H -1.606125 -0.600099 -1.334947


