%chk=000272452.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272452

0 1
O -3.327031 1.094171 1.159490
O -1.114467 -2.521180 0.887357
O 1.660724 3.442735 -1.486185
O -0.233861 2.865498 -0.632488
O 5.509871 -1.139903 -0.020526
O 5.585063 0.750492 -1.072124
N -0.482129 0.680001 0.724618
N -2.741264 -1.300421 -0.178739
N 0.965053 2.665969 -0.860962
N 4.998860 -0.115880 -0.443930
C -1.293050 -0.227942 1.558190
C -1.725196 -1.474388 0.730619
C -2.484077 0.537802 2.172781
C 0.829275 0.462751 0.400454
C -3.267028 -2.444755 -0.965848
C -4.657109 -2.882721 -0.480685
C 1.563122 1.444228 -0.353529
C 1.517660 -0.726320 0.816266
C 2.933930 1.237681 -0.623066
C 3.571254 0.090411 -0.173984
C 2.846599 -0.908706 0.542264
C -5.747560 -1.865464 -0.798409
H -0.665052 -0.629296 2.410167
H -0.989636 1.477855 0.290788
H -2.143275 1.327708 2.866136
H -3.156147 -0.163837 2.711982
H -3.299857 -2.138295 -2.035881
H -2.550400 -3.299713 -0.892849
H -3.297653 -0.437354 -0.191758
H -4.904421 -3.856015 -0.953228
H -4.631038 -3.083068 0.609633
H 0.953379 -1.524038 1.319199
H 3.494395 2.000793 -1.194750
H 3.377149 -1.818883 0.856279
H -5.792737 -1.636037 -1.869524
H -6.735507 -2.243655 -0.506959
H -5.596677 -0.920237 -0.263899
H -3.028659 1.995911 0.903500


%chk=000272452-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000272452

0 1
O -3.188354 1.192682 0.900158
O -1.165034 -2.615510 1.014000
O 1.785212 3.546926 -1.432567
O -0.252098 2.904795 -0.646457
O 5.573772 -1.237762 -0.015181
O 5.670393 0.773589 -1.096623
N -0.485177 0.668655 0.695646
N -2.744879 -1.350499 -0.166408
N 1.031542 2.691461 -0.832208
N 5.032078 -0.142566 -0.444255
C -1.316755 -0.216241 1.521645
C -1.751684 -1.514319 0.764154
C -2.494278 0.609248 2.068036
C 0.834839 0.464660 0.396077
C -3.259047 -2.462656 -0.986530
C -4.660245 -2.944399 -0.540364
C 1.613810 1.442677 -0.341257
C 1.519236 -0.733794 0.808519
C 2.983963 1.240335 -0.611744
C 3.602303 0.067373 -0.165507
C 2.871112 -0.928165 0.541459
C -5.757487 -1.866619 -0.678588
H -0.734870 -0.581742 2.388144
H -0.923116 1.506121 0.270922
H -2.108520 1.413697 2.724068
H -3.175994 -0.046265 2.643574
H -3.295347 -2.132442 -2.043191
H -2.529411 -3.286365 -0.905368
H -3.172367 -0.416872 -0.235536
H -4.926301 -3.824834 -1.157842
H -4.599510 -3.296439 0.507102
H 0.948660 -1.528561 1.298690
H 3.547946 1.997855 -1.161611
H 3.383768 -1.842214 0.852160
H -5.840132 -1.513867 -1.724295
H -6.743681 -2.265189 -0.380522
H -5.547844 -0.988499 -0.038540
H -3.783999 1.931642 1.170639


