%chk=000202830.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202830

0 1
O -1.303542 0.643709 -0.720047
O -7.610931 0.313452 0.717991
N -4.924508 0.649281 -0.195857
C 1.013243 0.613295 -1.079039
C 1.445196 0.161960 0.358319
C 3.389177 -0.282353 -1.345328
C 2.152566 0.308322 -2.087959
C 2.708651 0.942364 0.673949
C 1.853079 -1.297611 0.278879
C 3.761213 0.704538 -0.251804
C 2.907782 -1.539959 -0.642714
C -0.300665 -0.060540 -1.494521
C 2.887740 1.822451 1.731023
C 1.293622 -2.344987 0.996843
C 4.981294 1.348930 -0.109717
C 3.392273 -2.825432 -0.835656
C 4.127148 2.472646 1.872076
C 1.788767 -3.646480 0.799424
C 5.158916 2.239419 0.964745
C 2.823360 -3.883462 -0.103972
C -2.642428 0.119235 -0.897392
C -3.503523 1.108323 -0.095061
C -5.254083 -0.326637 0.895399
C -5.871557 1.811594 -0.140763
C -6.701376 -0.805932 0.701688
C -7.304955 1.281161 -0.306756
H 0.833480 1.716729 -1.043237
H 0.623500 0.344173 1.079505
H 4.221187 -0.475155 -2.049037
H 2.445820 1.232782 -2.614841
H 1.824856 -0.403131 -2.865278
H -0.328368 -1.135055 -1.244632
H -0.520576 0.080365 -2.566770
H 2.088341 2.010683 2.443472
H 0.488235 -2.168489 1.705470
H 5.793172 1.172700 -0.810454
H 4.200660 -3.020257 -1.535599
H 4.276428 3.162694 2.700340
H 1.358310 -4.472518 1.362222
H 6.113990 2.747196 1.084542
H 3.200287 -4.894340 -0.246648
H -2.907509 0.114703 -1.967956
H -2.683698 -0.907005 -0.497479
H -3.120599 1.184905 0.945052
H -3.384107 2.122835 -0.535011
H -5.134536 0.104802 1.912815
H -4.556892 -1.187491 0.819181
H -5.628247 2.501366 -0.977018
H -5.792117 2.391493 0.803703
H -6.827063 -1.356739 -0.247111
H -7.058135 -1.413964 1.550944
H -8.063068 2.063323 -0.128490
H -7.456109 0.815407 -1.296636


%chk=000202830-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202830

0 1
O -1.237621 0.866889 -0.736269
O -7.585929 -0.134614 0.751460
N -4.924040 0.611764 -0.150777
C 1.145228 0.799814 -1.187028
C 1.489018 0.398432 0.306079
C 3.421062 -0.402157 -1.277456
C 2.281303 0.277716 -2.132124
C 2.829406 1.060994 0.610576
C 1.698916 -1.111857 0.329885
C 3.877013 0.632334 -0.250828
C 2.752282 -1.547875 -0.521565
C -0.227670 0.268632 -1.618176
C 3.080995 2.021984 1.607968
C 0.958411 -2.048499 1.076485
C 5.173432 1.162734 -0.113132
C 3.064418 -2.916930 -0.622633
C 4.387003 2.555045 1.750289
C 1.275743 -3.426953 0.980797
C 5.428388 2.127562 0.894084
C 2.324393 -3.859261 0.135524
C -2.586212 0.348576 -0.985929
C -3.533472 1.117149 -0.053005
C -5.152491 -0.616408 0.655137
C -5.940405 1.640677 0.191827
C -6.574070 -1.149274 0.413133
C -7.351922 1.080166 -0.047952
H 1.104155 1.904229 -1.222122
H 0.680275 0.728770 0.976732
H 4.245127 -0.747003 -1.925734
H 2.709825 1.109461 -2.718669
H 1.885163 -0.468604 -2.847457
H -0.258813 -0.841250 -1.539342
H -0.436423 0.549865 -2.675062
H 2.273037 2.353676 2.270737
H 0.145133 -1.710671 1.729708
H 5.981058 0.830387 -0.776458
H 3.876688 -3.252395 -1.278558
H 4.591903 3.299118 2.528424
H 0.709698 -4.160614 1.566106
H 6.436328 2.541442 1.012154
H 2.567285 -4.925927 0.069188
H -2.883724 0.510692 -2.043898
H -2.612650 -0.745086 -0.783450
H -3.133075 1.067110 0.988716
H -3.519946 2.181254 -0.351142
H -5.020257 -0.411716 1.748217
H -4.419212 -1.391405 0.365131
H -5.784475 2.527442 -0.451144
H -5.855874 1.967414 1.259172
H -6.683015 -1.446950 -0.652211
H -6.792633 -2.011616 1.064601
H -8.125727 1.797479 0.272162
H -7.479329 0.847560 -1.127374


