%chk=000299594.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299594

0 1
O 1.848854 1.843913 0.423455
O 4.934114 -1.207508 -0.379877
N 0.459105 -0.031748 0.532901
N 2.745696 -0.155919 1.173902
C -3.162111 -2.434102 0.625712
C -4.201248 -2.026931 -0.422246
C -1.817091 -1.759339 0.327413
C -4.434526 -0.513198 -0.375138
C -1.936747 -0.277956 0.079371
C -3.165145 0.294032 -0.288938
C -0.794513 0.566387 0.171518
C -3.254825 1.671249 -0.562081
C -0.893906 1.937809 -0.101205
C -2.125817 2.480496 -0.469794
C 1.689451 0.658724 0.663415
C 4.111509 0.421372 1.095142
C 4.756756 0.228064 -0.283430
C 5.467098 -1.636469 -1.645102
H -3.038849 -3.532499 0.642429
H -3.512109 -2.145986 1.636403
H -5.153349 -2.562662 -0.252274
H -3.856422 -2.323825 -1.432055
H -1.361696 -2.227364 -0.572956
H -1.123359 -1.962072 1.170766
H -5.064982 -0.259583 0.505079
H -5.021654 -0.202556 -1.263688
H -4.209582 2.106336 -0.846339
H -0.013988 2.586477 -0.028437
H -2.198306 3.546627 -0.683898
H 0.401892 -0.992851 0.885480
H 2.737820 -1.156336 0.952031
H 4.723905 -0.085052 1.878245
H 4.071715 1.509665 1.344167
H 5.741547 0.721134 -0.347974
H 4.110058 0.579693 -1.106270
H 6.460074 -1.208174 -1.810275
H 4.784095 -1.378078 -2.459710
H 5.531735 -2.724771 -1.521844


%chk=000299594-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299594

0 1
O 1.715751 2.207974 0.498590
O 4.915330 -1.435044 -0.225091
N 0.382955 0.247823 0.366793
N 2.704565 0.093134 0.567200
C -3.001033 -2.526650 0.393110
C -4.106187 -2.058635 -0.574500
C -1.730946 -1.658068 0.238882
C -4.520760 -0.618040 -0.214208
C -2.012890 -0.157611 0.123209
C -3.329610 0.331379 -0.088993
C -0.928496 0.778774 0.204455
C -3.555162 1.727383 -0.188882
C -1.166612 2.173612 0.115892
C -2.484250 2.635495 -0.077521
C 1.601475 0.943664 0.477181
C 4.066777 0.614084 0.697458
C 4.976811 0.027886 -0.384453
C 5.713011 -2.143909 -1.223305
H -2.744422 -3.589039 0.221145
H -3.379964 -2.447412 1.431627
H -4.981801 -2.732729 -0.520325
H -3.726555 -2.094417 -1.615384
H -1.173658 -1.998150 -0.662733
H -1.072319 -1.859380 1.111904
H -5.074420 -0.637524 0.748416
H -5.226647 -0.217248 -0.966538
H -4.575148 2.094009 -0.357104
H -0.324213 2.862240 0.196552
H -2.667395 3.713471 -0.150526
H 0.438573 -0.770075 0.414425
H 2.626263 -0.919964 0.458139
H 4.483634 0.365741 1.693371
H 4.010093 1.712791 0.608945
H 6.020903 0.385896 -0.250826
H 4.619911 0.314339 -1.397296
H 6.787434 -1.874186 -1.147365
H 5.362317 -1.926229 -2.254603
H 5.591885 -3.218385 -1.013743


