%chk=000240998.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240998

0 1
O -3.176310 0.226314 1.889672
O 3.176362 0.226459 -1.889774
N -3.589917 -1.276562 0.194530
N 3.590034 -1.276448 -0.194673
C -5.020433 -1.024494 -0.114779
C -3.990458 -1.128365 -1.228489
C 5.020547 -1.024327 0.114607
C 3.990599 -1.128237 1.228339
C -2.754912 -0.363433 0.918246
C 2.754987 -0.363337 -0.918367
C -1.330990 -0.343904 0.446988
C 1.331070 -0.343862 -0.447100
C -0.668636 0.912692 0.243277
C 0.668661 0.912709 -0.243444
C -0.675520 -1.532768 0.219682
C 0.675651 -1.532747 -0.219749
C -1.309430 2.166229 0.508035
C 1.309405 2.166255 -0.508263
C -0.661859 3.349915 0.264063
C 0.661790 3.349927 -0.264346
H -5.475238 -0.062013 0.136613
H -5.702225 -1.856535 0.093055
H -3.918678 -2.037561 -1.836123
H -3.698383 -0.242534 -1.797874
H 5.475310 -0.061829 -0.136795
H 5.702365 -1.856342 -0.093242
H 3.918866 -2.037436 1.835973
H 3.698503 -0.242418 1.797730
H -1.180224 -2.490607 0.374943
H 1.180393 -2.490571 -0.374979
H -2.316838 2.163941 0.932864
H 2.316812 2.163980 -0.933093
H -1.146088 4.304344 0.469538
H 1.145983 4.304365 -0.469866


%chk=000240998-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240998

0 1
O -3.464039 0.742014 1.447941
O 3.464068 0.742109 -1.448117
N -3.487996 -1.300878 0.332122
N 3.488110 -1.300758 -0.332252
C -4.920173 -1.408797 -0.004476
C -3.840017 -1.751979 -1.043235
C 4.920299 -1.408646 0.004304
C 3.840181 -1.751841 1.043098
C -2.843833 -0.113803 0.746724
C 2.843913 -0.113695 -0.746840
C -1.389223 -0.030320 0.366148
C 1.389299 -0.030268 -0.366270
C -0.701842 1.235022 0.198594
C 0.701859 1.235047 -0.198764
C -0.686454 -1.231531 0.173863
C 0.686587 -1.231505 -0.173941
C -1.363114 2.495870 0.392917
C 1.363072 2.495918 -0.393139
C -0.685521 3.700058 0.198342
C 0.685424 3.700082 -0.198611
H -5.472712 -0.468612 -0.117908
H -5.469341 -2.218702 0.485936
H -3.627968 -2.800257 -1.278486
H -3.679320 -1.044832 -1.866078
H 5.472822 -0.468448 0.117711
H 5.469468 -2.218543 -0.486118
H 3.628160 -2.800122 1.278363
H 3.679494 -1.044690 1.865939
H -1.208413 -2.181225 0.321537
H 1.208592 -2.181179 -0.321578
H -2.402475 2.492561 0.726747
H 2.402434 2.492643 -0.726968
H -1.208259 4.650032 0.355308
H 1.208118 4.650074 -0.355615


