%chk=000244972.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244972

0 1
O -4.175728 -2.369706 -1.338569
O -2.642589 -1.441368 -2.688848
O -4.647834 2.522123 0.615338
O -4.263771 0.825034 2.032871
N 2.680679 1.215391 0.077963
N -1.871190 0.341840 -0.573647
N 2.072293 2.162434 -0.747388
N 0.831969 1.894410 -0.925460
N 1.822882 -0.863690 1.202727
N -0.602459 -1.203353 0.716922
N 0.632458 -2.730509 2.015846
C 4.124234 1.227223 0.398948
C 4.892444 0.256208 -0.509359
C 1.728309 0.251757 0.423560
C -3.089346 -0.471513 -0.438030
C 0.518367 0.709427 -0.229637
C 6.392168 0.283717 -0.188899
C -0.660844 -0.067079 -0.039760
C -4.332036 0.429404 -0.392955
C 7.169346 -0.678055 -1.083952
C 0.623169 -1.552352 1.300303
C -3.217362 -1.430464 -1.632729
C -4.386335 1.202247 0.895368
H 4.503066 2.269779 0.279825
H 4.241753 0.941136 1.471532
H 4.724636 0.515562 -1.574071
H 4.494754 -0.772565 -0.384966
H -3.032112 -1.097220 0.512737
H 6.788636 1.311041 -0.313973
H 6.557537 0.018391 0.874409
H -1.865800 1.091025 -1.272184
H -5.253986 -0.200084 -0.468792
H -4.376691 1.123222 -1.264821
H 8.240302 -0.657318 -0.851472
H 6.827325 -1.712477 -0.960305
H 7.059777 -0.422857 -2.144684
H -0.236286 -3.201465 2.217658
H 1.448220 -2.981390 2.553880
H -4.290102 -3.046075 -2.061774
H -4.696355 3.090669 1.432688


%chk=000244972-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244972

0 1
O -4.347029 -2.266563 -1.416111
O -2.442722 -1.616624 -2.582943
O -5.020734 2.448646 0.764738
O -3.966167 0.805541 2.025084
N 2.673176 1.170998 0.019216
N -1.858661 0.342084 -0.607163
N 2.099933 2.180777 -0.826843
N 0.794033 1.888488 -0.975026
N 1.816399 -0.849346 1.172788
N -0.604093 -1.157418 0.728515
N 0.595090 -2.626225 2.087813
C 4.104365 1.190377 0.339403
C 4.927478 0.219765 -0.537496
C 1.709508 0.254806 0.381164
C -3.076518 -0.444767 -0.471530
C 0.525451 0.724409 -0.252593
C 6.429091 0.257971 -0.174589
C -0.663441 -0.042473 -0.045543
C -4.328372 0.460884 -0.398006
C 7.269811 -0.699282 -1.046575
C 0.611116 -1.497797 1.303032
C -3.208912 -1.469702 -1.613316
C -4.385590 1.211609 0.921984
H 4.446650 2.229958 0.196135
H 4.217185 0.925825 1.407066
H 4.789399 0.490261 -1.602293
H 4.536548 -0.807557 -0.405968
H -2.991075 -1.020137 0.469579
H 6.810242 1.293364 -0.288120
H 6.555517 -0.008044 0.894799
H -1.824494 1.112369 -1.278592
H -5.232920 -0.171641 -0.465561
H -4.368564 1.180230 -1.234353
H 8.339019 -0.663280 -0.768902
H 6.925012 -1.744025 -0.932785
H 7.188728 -0.434087 -2.117241
H -0.280117 -3.124356 2.220495
H 1.454051 -2.925329 2.540608
H -4.408639 -2.945017 -2.141617
H -5.076257 2.907806 1.647047


