%chk=000288533.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288533

0 1
O 6.471922 0.983720 0.699684
O 5.528266 1.068300 -1.355096
N 0.378582 -0.539106 0.200651
N -3.937530 1.138502 -0.232568
C 3.286553 -0.495828 -0.234373
C 2.528509 -1.789033 0.159449
C 2.507896 0.726017 0.286556
C 1.074232 -1.737713 -0.369614
C 1.062383 0.723751 -0.231918
C 4.715679 -0.511961 0.340425
C -1.070185 -0.531065 -0.183761
C 3.203624 -3.011996 -0.408092
C -1.853675 0.253121 0.889129
C 5.557706 0.581345 -0.249285
C -3.314447 0.196847 0.623975
C 3.566149 -4.058782 0.329517
C -4.265539 -0.692197 1.095238
C -5.311015 0.835025 -0.297710
C -5.536816 -0.316288 0.532616
C 7.419776 2.039394 0.346768
C -6.353194 1.463699 -1.003692
C -6.840115 -0.831965 0.643900
C -7.622428 0.924909 -0.867649
C -7.864236 -0.210310 -0.053198
C 6.732275 3.388110 0.397914
H 3.355412 -0.432906 -1.349937
H 2.485345 -1.847031 1.277008
H 2.501073 0.728877 1.394926
H 3.011734 1.660216 -0.026270
H 1.068371 -1.756046 -1.480127
H 0.534218 -2.647068 -0.024321
H 1.052699 0.865417 -1.334575
H 0.510349 1.581671 0.209851
H 5.207628 -1.488529 0.127949
H 4.700881 -0.438345 1.449528
H -1.258769 -0.101933 -1.190056
H -1.453326 -1.575975 -0.212812
H 3.375303 -2.983786 -1.485937
H -1.630878 -0.180951 1.891377
H -1.489559 1.298635 0.952021
H 4.044301 -4.936138 -0.082666
H 3.411850 -4.127365 1.397140
H -3.482116 1.892454 -0.705456
H -4.105395 -1.514916 1.760495
H 7.840366 1.814915 -0.649486
H 8.181950 1.907605 1.136295
H -6.165478 2.331805 -1.625144
H -7.026828 -1.701974 1.268534
H -8.461412 1.376907 -1.394520
H -8.880449 -0.592250 0.018369
H 7.450043 4.208956 0.285478
H 5.990537 3.484936 -0.409254
H 6.201381 3.534127 1.347122


%chk=000288533-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000288533

0 1
O 6.697268 0.881183 0.574027
O 5.300680 1.439049 -1.210695
N 0.321229 -0.509831 0.231036
N -4.032022 0.818679 -0.478450
C 3.247751 -0.398952 -0.213758
C 2.514226 -1.739866 0.105115
C 2.438449 0.791541 0.353865
C 1.038588 -1.657111 -0.375332
C 0.978260 0.770206 -0.131307
C 4.693965 -0.410528 0.326485
C -1.126693 -0.532022 -0.081191
C 3.189659 -2.926400 -0.553936
C -1.964177 0.322662 0.911670
C 5.544878 0.730991 -0.204679
C -3.444851 0.229824 0.660998
C 3.662510 -4.024176 0.088020
C -4.451208 -0.401432 1.394905
C -5.411297 0.574057 -0.482934
C -5.705146 -0.201044 0.697283
C 7.661672 1.945064 0.152154
C -6.409847 0.962040 -1.402036
C -7.048716 -0.589174 0.943993
C -7.735119 0.561889 -1.130260
C -8.050251 -0.205585 0.030084
C 7.304627 3.284262 0.802848
H 3.296457 -0.284976 -1.317653
H 2.500950 -1.884071 1.204615
H 2.445309 0.747213 1.461099
H 2.912132 1.741502 0.044387
H 1.031371 -1.599268 -1.497679
H 0.515230 -2.588046 -0.091077
H 0.954298 0.929515 -1.243079
H 0.423843 1.605645 0.332051
H 5.197721 -1.356517 0.042376
H 4.711322 -0.380513 1.432283
H -1.327939 -0.195343 -1.132654
H -1.478915 -1.577739 -0.010979
H 3.279636 -2.869229 -1.652015
H -1.744370 -0.033243 1.932428
H -1.636046 1.380482 0.865057
H 4.127134 -4.854456 -0.456063
H 3.593713 -4.125346 1.178767
H -3.525684 1.347660 -1.185510
H -4.301500 -0.941382 2.328744
H 7.646763 2.017310 -0.949582
H 8.636326 1.564077 0.497193
H -6.173090 1.552102 -2.294896
H -7.303027 -1.178042 1.832502
H -8.536284 0.845562 -1.822020
H -9.090874 -0.498845 0.208908
H 8.072926 4.038973 0.551218
H 6.330741 3.650431 0.436511
H 7.261026 3.189023 1.901558


