%chk=000276844.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276844

0 1
O -7.467761 0.403078 -0.782164
O 7.466725 0.405747 0.781854
O -7.612633 3.222797 -0.126099
O 7.610573 3.225379 0.125212
O 2.351281 -4.895604 0.077369
O -2.350282 -4.896646 -0.075685
O 3.435587 -3.157695 0.760977
O -3.435348 -3.159506 -0.760030
N 2.429812 -3.709490 0.351062
N -2.429337 -3.710675 -0.349852
C -1.217834 -1.487119 -0.167205
C 1.217319 -1.486552 0.167761
C -0.000395 -0.810995 0.000174
C 1.202106 -2.905080 0.175884
C -1.202001 -2.905645 -0.174925
C 0.000205 -3.602616 0.000579
C -2.458152 -0.723985 -0.337748
C 2.457319 -0.722844 0.338118
C -4.073836 1.039144 0.313821
C 4.072562 1.040371 -0.314216
C -2.823796 0.280260 0.473030
C 2.822806 0.280974 -0.473246
C -5.237876 0.416119 -0.162337
C 5.236822 0.417858 0.162067
C -4.095961 2.401272 0.656008
C 4.094186 2.402429 -0.656692
C -6.422596 1.152603 -0.306296
C 6.421279 1.154797 0.305858
C -6.428329 2.530372 0.032763
C 6.426512 2.532497 -0.033492
C -5.268257 3.146619 0.510881
C 5.266217 3.148228 -0.511730
C -8.752272 1.057283 -0.953451
C 8.750971 1.060483 0.953088
H -0.000616 0.282760 -0.000011
H 0.000445 -4.709619 0.000738
H -3.092789 -1.049302 -1.177590
H 3.091845 -1.047389 1.178336
H -2.199767 0.588421 1.319288
H 2.198899 0.588354 -1.319874
H -5.247950 -0.647268 -0.416943
H 5.247266 -0.645473 0.416898
H -3.197347 2.887596 1.030883
H 3.195393 2.888346 -1.031665
H -5.277838 4.202604 0.771203
H 5.275417 4.204161 -0.772276
H -7.510400 4.169402 0.146053
H 7.507975 4.171909 -0.147061
H -9.371789 0.233286 -1.326225
H -9.113769 1.434698 0.008403
H -8.667126 1.866098 -1.686380
H 9.370795 0.236792 1.326028
H 8.665478 1.869391 1.685873
H 9.112362 1.437876 -0.008817


%chk=000276844-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276844

0 1
O -7.208795 1.067790 -1.421024
O 7.206682 1.079098 1.418408
O -7.203161 3.680880 -0.218776
O 7.202168 3.682154 0.195373
O 2.306881 -5.343813 -0.032364
O -2.308221 -5.343203 0.069249
O 3.501950 -3.593691 0.790677
O -3.502979 -3.598385 -0.765448
N 2.409075 -4.101334 0.313088
N -2.410238 -4.102991 -0.284327
C -1.256960 -1.801068 -0.141973
C 1.256070 -1.800272 0.155747
C -0.000391 -1.153981 0.004764
C 1.211663 -3.242155 0.171474
C -1.212745 -3.243032 -0.148193
C -0.000585 -3.934054 0.013921
C -2.486755 -1.007437 -0.254198
C 2.485927 -1.005987 0.262813
C -3.812956 1.125949 0.091291
C 3.812212 1.124917 -0.097606
C -2.618787 0.285904 0.198283
C 2.618183 0.283988 -0.199114
C -5.003119 0.712940 -0.575502
C 5.001755 0.717228 0.573569
C -3.794768 2.420285 0.687103
C 3.794497 2.414556 -0.703524
C -6.132830 1.545658 -0.664175
C 6.131303 1.550705 0.656789
C -6.082405 2.848879 -0.073523
C 6.081405 2.849204 0.055818
C -4.914934 3.265907 0.607097
C 4.914557 3.260840 -0.629134
C -8.573109 1.172202 -0.856250
C 8.571284 1.178980 0.853499
H -0.000293 -0.061510 0.001263
H -0.000676 -5.026318 0.017469
H -3.342704 -1.515418 -0.700885
H 3.341632 -1.510724 0.713644
H -1.778118 0.755324 0.730252
H 1.777806 0.749317 -0.735126
H -5.079551 -0.270416 -1.049026
H 5.077724 -0.262317 1.054999
H -2.897170 2.759763 1.216317
H 2.897379 2.749808 -1.236234
H -4.883303 4.264034 1.063727
H 4.883350 4.255327 -1.093672
H -7.036935 4.568321 0.186804
H 7.036400 4.566401 -0.217304
H -9.217701 0.678595 -1.598516
H -8.629701 0.632182 0.108080
H -8.868475 2.224569 -0.721008
H 9.215561 0.691566 1.600117
H 8.866608 2.230253 0.709812
H 8.628389 0.631083 -0.106346


