%chk=000268821.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268821

0 1
O -1.112560 1.226524 -1.745205
O -3.864546 1.627461 1.952424
O -2.362561 -3.191616 -2.434087
N -2.450000 -0.422840 0.041765
C 3.623544 0.003365 1.129063
C 2.347817 0.325125 0.377339
C -1.401731 0.062548 1.003512
C -0.096745 0.325895 0.299278
C 4.481466 -1.031210 0.367051
C 1.107367 0.037546 0.958725
C -3.818641 -0.339700 0.646785
C -2.151234 -1.800667 -0.460747
C 4.426901 1.284629 1.391814
C 2.389920 0.914306 -0.899263
C -0.021547 0.906627 -0.983474
C 1.216366 1.204553 -1.584529
C 3.794446 -2.390804 0.274045
C -4.290157 1.120626 0.668054
C -2.585609 -1.866157 -1.937140
H 3.356566 -0.440879 2.122756
H -1.769260 1.020370 1.459563
H -1.255756 -0.636090 1.856772
H 5.458737 -1.140676 0.876280
H 4.712502 -0.657401 -0.648848
H 1.073251 -0.415447 1.949819
H -3.860138 -0.744429 1.685337
H -4.523479 -0.945654 0.036270
H -2.648919 -2.606900 0.117648
H -1.060104 -2.008245 -0.388236
H 4.803101 1.730681 0.464965
H 5.288904 1.089704 2.037974
H 3.806518 2.041916 1.885716
H 3.351415 1.144250 -1.357466
H 1.227907 1.658583 -2.572803
H 4.401526 -3.103242 -0.295048
H 3.617493 -2.824891 1.264040
H 2.821731 -2.311105 -0.227693
H -3.837891 1.730076 -0.134716
H -5.391682 1.189315 0.617721
H -3.674991 -1.732184 -2.065570
H -2.044725 -1.129533 -2.559596
H -1.974853 0.891344 -1.318592
H -4.019011 2.589924 2.004489
H -1.405838 -3.362501 -2.539394


%chk=000268821-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268821

0 1
O -1.251726 1.197854 -1.518466
O -3.692081 2.005560 1.500866
O -2.625774 -3.327960 -2.388158
N -2.465058 -0.431645 0.086915
C 3.723090 -0.023630 1.172733
C 2.405345 0.299743 0.462695
C -1.405185 -0.029774 1.091337
C -0.072218 0.250983 0.411451
C 4.633385 -0.971714 0.336740
C 1.158957 -0.052021 1.036366
C -3.852168 -0.256685 0.613932
C -2.226230 -1.801355 -0.469725
C 4.491777 1.270536 1.553078
C 2.387882 0.971428 -0.789804
C -0.057227 0.911012 -0.857074
C 1.177982 1.268044 -1.448118
C 4.005056 -2.354595 0.064173
C -4.378975 1.177483 0.494755
C -2.790983 -1.951599 -1.898393
H 3.474490 -0.557058 2.114745
H -1.789430 0.887013 1.574659
H -1.292971 -0.810171 1.875722
H 5.593734 -1.099792 0.876550
H 4.880778 -0.479623 -0.625886
H 1.146609 -0.567906 2.006949
H -3.917970 -0.578723 1.676413
H -4.527367 -0.910077 0.032155
H -2.663751 -2.586908 0.183604
H -1.132044 -1.961939 -0.497176
H 4.789429 1.833446 0.648404
H 5.411760 1.030249 2.119049
H 3.865950 1.938231 2.172007
H 3.333170 1.263548 -1.264039
H 1.164611 1.777246 -2.417159
H 4.687531 -2.996400 -0.523090
H 3.778060 -2.879954 1.011735
H 3.059769 -2.253681 -0.499163
H -4.195134 1.556716 -0.531381
H -5.472808 1.172888 0.688625
H -3.881880 -1.788125 -1.918524
H -2.311097 -1.213925 -2.572980
H -1.982086 0.632819 -1.002679
H -3.835261 2.964252 1.304744
H -1.664440 -3.500597 -2.551788


