%chk=000298495.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298495

0 1
O -2.885145 2.520928 -0.467529
O -4.544745 -2.540224 0.407659
N 7.796414 0.327163 0.320165
N 1.389287 -0.020656 0.413532
N 2.266104 -0.760172 -0.097971
C -2.283939 0.277757 0.009116
C -2.719737 -1.042167 0.234092
C -4.709460 1.023425 -0.277442
C -5.141463 -0.295050 -0.050631
C -3.257489 1.383303 -0.264495
C -4.168668 -1.400929 0.215234
C -0.923437 0.582896 0.038871
C -1.782449 -2.051892 0.482579
C -5.648873 2.031437 -0.522610
C -6.508570 -0.592997 -0.071145
C 0.013538 -0.442503 0.287811
C -0.415569 -1.760402 0.507061
C -7.016072 1.728439 -0.541950
C -7.444980 0.419117 -0.316728
C 6.408845 0.141877 0.151924
C 3.636609 -0.382383 0.034055
C 5.911933 -0.970828 -0.578373
C 5.481257 0.991673 0.812944
C 4.550954 -1.229710 -0.630779
C 4.121729 0.729587 0.756423
C 8.276348 1.665892 0.752276
C 8.712589 -0.318765 -0.655794
H -0.587722 1.613110 -0.129528
H -2.132828 -3.075797 0.654241
H -5.302170 3.054877 -0.698289
H -6.834331 -1.622998 0.106527
H 0.314253 -2.550767 0.692586
H -7.742902 2.518260 -0.733431
H -8.508763 0.180444 -0.331257
H 6.598165 -1.638967 -1.094305
H 5.832045 1.851036 1.380561
H 4.175737 -2.090003 -1.191237
H 3.414124 1.386677 1.270425
H 8.129993 2.448585 -0.009626
H 9.350092 1.613666 0.998518
H 7.751689 1.972315 1.675594
H 8.649746 0.115882 -1.666542
H 8.488250 -1.398836 -0.723472
H 9.753311 -0.231201 -0.301261


%chk=000298495-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298495

0 1
O -2.968163 2.664379 0.101090
O -4.504800 -2.632205 -0.251026
N 7.796256 0.475123 0.191452
N 1.404334 0.111396 0.002664
N 2.296276 -0.855182 -0.109020
C -2.307511 0.343700 -0.040210
C -2.707984 -1.024732 -0.134309
C -4.764313 1.055225 -0.011218
C -5.159262 -0.312091 -0.101006
C -3.319452 1.443979 0.022004
C -4.144746 -1.411772 -0.168461
C -0.935149 0.670544 -0.002200
C -1.712464 -2.037786 -0.193349
C -5.752540 2.068983 0.049949
C -6.536428 -0.643143 -0.127221
C 0.052584 -0.344139 -0.059550
C -0.350484 -1.713032 -0.157540
C -7.120128 1.731019 0.023246
C -7.512937 0.370916 -0.065332
C 6.440828 0.172997 0.118530
C 3.641833 -0.439012 -0.026247
C 5.989897 -1.172500 -0.102752
C 5.443724 1.202729 0.263846
C 4.622740 -1.461806 -0.170096
C 4.082735 0.903693 0.191697
C 8.239941 1.859169 0.425156
C 8.800604 -0.589241 0.035575
H -0.631399 1.718839 0.073619
H -2.048095 -3.077352 -0.265707
H -5.419677 3.109524 0.118630
H -6.810313 -1.700673 -0.196344
H 0.425646 -2.482367 -0.199776
H -7.880308 2.518064 0.071161
H -8.576380 0.109307 -0.085765
H 6.710585 -1.985575 -0.219689
H 5.748486 2.238872 0.434419
H 4.274582 -2.486776 -0.336474
H 3.326659 1.687332 0.301569
H 7.895675 2.539631 -0.378208
H 9.339884 1.890936 0.448204
H 7.867090 2.249616 1.392461
H 8.721737 -1.081515 -0.953743
H 8.695135 -1.367374 0.817256
H 9.809001 -0.156601 0.120516


