%chk=000235486.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235486

0 1
O 1.847580 0.738628 1.145614
O 2.590426 3.113437 -0.787874
O 3.944479 -0.004259 -1.397637
O 4.765562 -1.439589 0.759803
N 0.461580 0.172216 -0.686274
N -0.008079 -1.826107 -1.742325
N -1.847671 0.726575 0.094728
N -3.488390 -1.005099 -0.595182
N -4.179247 1.013102 0.482444
C 2.395289 1.714646 -0.987554
C 1.239942 1.246254 -0.054326
C 3.661684 1.012862 -0.435798
C 3.255204 0.447557 0.950747
C 3.420140 -1.072261 1.098722
C -0.918163 -0.047199 -0.526749
C 0.956882 -0.970752 -1.426172
C -1.198861 -1.294441 -1.202862
C -2.535884 -1.735332 -1.198209
C -3.136767 0.215093 0.015005
C -5.502508 0.384977 0.721174
C -3.849221 2.137573 1.393285
H 2.232461 1.483135 -2.062149
H 0.563563 2.062757 0.306488
H 4.526526 1.707917 -0.375795
H 3.753371 1.000666 1.777139
H 2.804804 -1.633582 0.365868
H 3.163655 -1.412890 2.115964
H 2.142656 3.626968 -1.495175
H 4.648015 -0.625175 -1.049942
H 2.014547 -1.043764 -1.682559
H 5.383343 -1.204635 1.481929
H -2.837640 -2.677623 -1.674046
H -5.526312 -0.222188 1.640531
H -5.767815 -0.278917 -0.126562
H -6.273364 1.169333 0.784513
H -3.551291 1.797801 2.398931
H -4.717670 2.809024 1.480662
H -3.007426 2.725590 0.976544


%chk=000235486-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235486

0 1
O 1.863323 0.470778 1.174710
O 2.485124 3.053057 -0.525985
O 3.796384 -0.182798 -1.441096
O 5.216486 -1.140261 0.693562
N 0.393004 -0.032870 -0.700910
N -0.163728 -1.914194 -1.910930
N -1.854603 0.612185 0.094767
N -3.610503 -0.926579 -0.703213
N -4.129594 0.926162 0.672397
C 2.278611 1.650220 -0.900440
C 1.173300 0.998965 -0.018232
C 3.585406 0.929380 -0.513277
C 3.335525 0.467875 0.954581
C 3.847904 -0.959420 1.237487
C -0.995049 -0.181353 -0.574825
C 0.833814 -1.113079 -1.514717
C -1.325827 -1.348538 -1.333459
C -2.696943 -1.681441 -1.365280
C -3.168426 0.186936 0.005451
C -5.552706 0.567596 0.621249
C -3.774937 2.107067 1.467315
H 2.065624 1.538405 -1.979896
H 0.435135 1.738275 0.343036
H 4.422142 1.649415 -0.570561
H 3.770949 1.204863 1.657097
H 3.224345 -1.687199 0.697789
H 3.815945 -1.189634 2.317522
H 1.679095 3.581439 -0.753079
H 4.585601 -0.690926 -1.095486
H 1.887858 -1.218808 -1.770107
H 5.883774 -0.718684 1.288593
H -3.075696 -2.547532 -1.918482
H -5.934712 0.354152 1.639393
H -5.669246 -0.325654 -0.007493
H -6.145691 1.401222 0.195191
H -4.126348 1.986953 2.511143
H -4.246848 3.017894 1.046990
H -2.683092 2.228429 1.462095


