%chk=000252918.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252918

0 1
S 0.903899 -2.809326 -0.003578
O 2.019022 2.217803 0.004010
N 0.100245 0.232270 -0.000493
N 3.292554 -1.702504 -0.001229
N 3.804069 0.662930 0.002243
C -0.908893 -0.750496 -0.002174
C 1.471545 -0.090014 0.000343
C -2.286430 -0.183098 -0.002573
C 1.967044 -1.408888 -0.001318
C -0.677566 -2.074172 -0.004258
C 2.473136 0.933161 0.002142
C -2.935843 0.069154 1.213911
C -2.928387 0.086423 -1.219295
C -4.231380 0.593410 1.209294
C -4.223965 0.610571 -1.215179
C -4.874731 0.864485 -0.003059
C 4.164627 -0.658534 0.000719
C 3.027080 3.276549 0.006164
H -0.151074 1.218858 0.003397
H -1.485332 -2.805645 -0.006647
H -2.432674 -0.147913 2.156297
H -2.419425 -0.117291 -2.161553
H -4.740586 0.789227 2.152189
H -4.727445 0.819694 -2.158288
H -5.884912 1.272353 -0.003272
H 5.241667 -0.886903 0.000277
H 2.397294 4.172254 0.007303
H 3.643981 3.202166 -0.895127
H 3.643179 3.199275 0.907754


%chk=000252918-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000252918

0 1
S 0.983928 -2.780560 1.040064
O 1.942280 2.168892 -0.287852
N 0.168435 0.233313 0.470188
N 3.344773 -1.705188 0.168222
N 3.761520 0.621580 -0.366752
C -0.892085 -0.708104 0.498307
C 1.505899 -0.108216 0.247616
C -2.254408 -0.162685 0.250795
C 2.043185 -1.408731 0.410196
C -0.659298 -2.042705 0.679857
C 2.450970 0.882918 -0.153362
C -3.387904 -0.734485 0.892216
C -2.451741 0.946930 -0.618664
C -4.681187 -0.226071 0.655309
C -3.746918 1.460349 -0.846073
C -4.867843 0.875832 -0.213215
C 4.154963 -0.674508 -0.205066
C 2.903343 3.226101 -0.672334
H -0.053045 1.229979 0.457886
H -1.449581 -2.783622 0.558235
H -3.244352 -1.559514 1.598494
H -1.598583 1.383095 -1.152155
H -5.542330 -0.677567 1.160152
H -3.881801 2.309095 -1.525640
H -5.872294 1.275510 -0.389815
H 5.208034 -0.904941 -0.382130
H 2.298121 4.142611 -0.723400
H 3.359239 2.992191 -1.648663
H 3.699381 3.314302 0.085584


