%chk=000253727.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253727

0 1
O -6.526518 -0.766033 0.903331
O -6.287701 -0.425914 -1.321691
N 4.005318 0.655617 0.626334
N 1.873104 1.328863 0.601392
N 2.731193 0.452157 0.256795
C -3.682350 0.781821 -0.733602
C -2.219809 0.894665 -0.402751
C -4.367176 -0.226260 0.197164
C -1.279634 0.100147 -1.075080
C -1.786620 1.793320 0.586120
C 0.505853 1.098495 0.222728
C 0.077967 0.197073 -0.769132
C -0.434074 1.901327 0.901395
C -5.790734 -0.465354 -0.221322
C 4.963674 -0.312063 0.147898
C -7.942086 -1.093844 0.738028
C 6.280367 0.096498 -0.136188
C 4.586386 -1.660437 -0.010430
C 4.474456 1.864931 1.353510
C 7.212967 -0.852338 -0.561338
C 5.532660 -2.588494 -0.444920
C 6.846821 -2.192212 -0.716672
C -8.086678 -2.511310 0.224622
H -4.179194 1.771546 -0.655963
H -3.828309 0.474269 -1.793184
H -3.823800 -1.197902 0.186739
H -4.321358 0.116461 1.254245
H -1.607586 -0.597679 -1.844852
H -2.511832 2.413472 1.111376
H 0.803615 -0.420534 -1.298286
H -0.095265 2.601411 1.665551
H -8.397705 -0.348505 0.062057
H -8.307590 -0.964464 1.773034
H 6.577828 1.138212 -0.043826
H 3.564675 -1.976254 0.201978
H 4.666262 2.699507 0.658486
H 3.700387 2.203966 2.070154
H 5.386955 1.641899 1.927093
H 8.234149 -0.539312 -0.779001
H 5.243385 -3.632217 -0.569466
H 7.579361 -2.923889 -1.050042
H -9.133524 -2.836492 0.233127
H -7.723300 -2.597234 -0.810706
H -7.510037 -3.221113 0.831196


%chk=000253727-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253727

0 1
O -6.617475 -0.751146 1.005282
O -6.343222 -0.420555 -1.289904
N 4.059768 0.688618 0.546648
N 1.903099 1.361576 0.601116
N 2.753149 0.464297 0.167039
C -3.694709 0.726338 -0.798291
C -2.218556 0.884141 -0.472106
C -4.417827 -0.165304 0.246135
C -1.262421 -0.054760 -0.948379
C -1.758805 1.948986 0.344411
C 0.550387 1.127237 0.199880
C 0.101698 0.055356 -0.624309
C -0.395161 2.072404 0.677133
C -5.863673 -0.443910 -0.132053
C 5.018739 -0.267112 0.096378
C -8.050724 -1.120989 0.778241
C 6.392049 -0.094393 0.421228
C 4.624429 -1.397236 -0.675380
C 4.455299 1.849009 1.368743
C 7.348223 -1.035333 -0.019185
C 5.590820 -2.325141 -1.106570
C 6.959593 -2.156024 -0.784750
C -8.181800 -2.613535 0.462445
H -4.190477 1.714481 -0.827273
H -3.833256 0.273282 -1.796405
H -3.897329 -1.141012 0.324150
H -4.384251 0.281234 1.255005
H -1.598680 -0.877717 -1.592073
H -2.475605 2.691615 0.715883
H 0.828685 -0.669317 -1.002782
H -0.034757 2.895696 1.302826
H -8.446439 -0.500096 -0.044747
H -8.539791 -0.853602 1.728513
H 6.723998 0.764281 1.011042
H 3.570006 -1.529597 -0.923552
H 5.155753 2.498290 0.813358
H 3.536330 2.408423 1.597825
H 4.931895 1.513253 2.306874
H 8.402226 -0.885701 0.240600
H 5.271584 -3.189743 -1.699544
H 7.704736 -2.883000 -1.124102
H -9.250708 -2.885659 0.381781
H -7.692962 -2.855346 -0.496249
H -7.729333 -3.226487 1.261020


