%chk=000294414.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294414

0 1
O 0.116810 -1.796979 -1.230728
O -0.981956 2.803511 -0.834043
O 3.486563 -2.060609 -0.984227
O 2.719898 -2.472057 1.003603
N -2.124957 0.121190 0.964602
N 2.929927 -1.752370 0.049880
C -0.994972 0.379124 -1.172810
C 1.270181 0.117464 -0.283551
C 0.930275 1.483405 -0.152822
C 0.138127 -0.638854 -0.931515
C -0.437547 1.743628 -0.714297
C -2.223476 -0.002042 -0.391301
C 2.501980 -0.320895 0.176210
C 1.794032 2.395284 0.435339
C 3.393735 0.588969 0.778294
C 3.037031 1.931248 0.904477
C -3.386663 -0.463499 -1.029592
C -4.486358 -0.807812 -0.235651
C -3.201557 -0.216718 1.716639
C -4.401571 -0.685320 1.152938
H -1.225444 0.424312 -2.267116
H 1.511844 3.446802 0.533806
H 4.362672 0.241798 1.147582
H 3.730194 2.632579 1.375147
H -3.433439 -0.557735 -2.112045
H -5.403267 -1.170882 -0.702112
H -3.083521 -0.104601 2.801640
H -5.243339 -0.947642 1.789752


%chk=000294414-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294414

0 1
O 0.035480 -1.930042 -0.895668
O -0.980838 2.808707 -0.725086
O 2.916928 -2.242570 -1.190411
O 3.761484 -2.239453 0.935360
N -2.245899 0.102235 0.987306
N 3.111512 -1.702514 -0.042303
C -0.995797 0.332598 -1.090507
C 1.317872 0.086311 -0.259793
C 0.963747 1.451757 -0.113381
C 0.136808 -0.689915 -0.782363
C -0.415591 1.693770 -0.638482
C -2.290266 -0.016023 -0.376935
C 2.601693 -0.319095 0.166165
C 1.840193 2.402776 0.449549
C 3.481728 0.602661 0.770617
C 3.100791 1.961500 0.906695
C -3.443489 -0.447170 -1.070636
C -4.600984 -0.770247 -0.327089
C -3.369117 -0.210888 1.690708
C -4.567143 -0.650590 1.080158
H -1.167243 0.352667 -2.184013
H 1.528443 3.448085 0.534405
H 4.457190 0.254856 1.123298
H 3.799274 2.667119 1.367170
H -3.433136 -0.530862 -2.161808
H -5.509230 -1.108904 -0.836137
H -3.297508 -0.104444 2.778971
H -5.441700 -0.891026 1.692309


