%chk=000291772.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291772

0 1
O -0.809271 -3.279730 -0.000419
O -2.744012 -2.110363 -0.001178
O -0.164654 3.362393 0.000117
N 0.795681 -1.171114 -0.000331
C -0.851202 0.409511 -0.000524
C 1.416413 0.057462 -0.000186
C 0.416863 1.062818 -0.000286
C -0.603922 -0.977068 -0.000557
C -2.171403 1.049434 -0.000733
C 2.877247 0.202786 0.000032
C -1.537843 -2.095652 -0.000736
C -2.801509 1.351498 -1.217494
C -2.799319 1.356843 1.215817
C 0.691306 2.503722 -0.000141
C 3.571187 0.277925 1.217136
C 3.571104 0.281932 -1.216860
C -4.060439 1.958101 -1.212584
C -4.058271 1.963403 1.210506
C 4.960358 0.428558 1.212576
C 4.960281 0.432544 -1.211898
C -4.689281 2.263496 -0.001136
C 5.654632 0.505025 0.000437
C -1.586462 -4.526681 -0.000571
C -0.534413 -5.614445 -0.000206
H 1.229458 -2.082610 -0.000297
H -2.309660 1.117169 -2.159303
H -2.305714 1.126769 2.157759
H 1.764529 2.767196 -0.000252
H 3.027102 0.224418 2.160290
H 3.026957 0.231491 -2.160151
H -4.550826 2.194320 -2.154973
H -4.546951 2.203779 2.152731
H 5.502568 0.489105 2.155944
H 5.502423 0.496179 -2.155102
H -5.669230 2.736406 -0.001295
H 6.737961 0.623809 0.000599
H -2.221037 -4.523642 0.902774
H -2.220523 -4.523751 -0.904276
H -0.996635 -6.609607 -0.000302
H 0.115871 -5.546004 -0.882611
H 0.115337 -5.545927 0.882586


%chk=000291772-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291772

0 1
O -0.671363 -3.243364 0.011686
O -2.747511 -2.170432 -0.171920
O -0.087619 3.569754 0.004426
N 0.741019 -1.061062 -0.032499
C -0.928252 0.497706 -0.064929
C 1.382026 0.152765 0.013909
C 0.367045 1.163083 0.007617
C -0.653221 -0.894034 -0.091137
C -2.271591 1.128181 -0.080746
C 2.856501 0.224711 0.037950
C -1.499406 -2.090947 -0.093281
C -3.265783 0.686989 -0.995365
C -2.595419 2.179619 0.818759
C 0.705606 2.588922 0.090482
C 3.595403 -0.663973 0.869697
C 3.568579 1.140120 -0.786168
C -4.543818 1.283085 -1.014120
C -3.878096 2.764045 0.810910
C 5.005691 -0.632623 0.881729
C 4.978950 1.171803 -0.767708
C -4.858040 2.321922 -0.108400
C 5.703472 0.287759 0.065354
C -1.388867 -4.550852 0.015474
C -0.329338 -5.640991 0.143465
H 1.177173 -1.983696 -0.072456
H -3.037933 -0.124028 -1.692786
H -1.841528 2.542628 1.522298
H 1.793783 2.776205 0.263928
H 3.062290 -1.353964 1.534996
H 3.018644 1.797827 -1.467135
H -5.293967 0.931900 -1.731165
H -4.108503 3.570773 1.515282
H 5.558636 -1.316180 1.535084
H 5.511752 1.879839 -1.411440
H -5.852333 2.782840 -0.119716
H 6.798357 0.314820 0.077184
H -2.101634 -4.552845 0.859619
H -1.968363 -4.632737 -0.921982
H -0.815794 -6.633317 0.149461
H 0.377563 -5.609421 -0.703681
H 0.240588 -5.531330 1.082221


