%chk=000242106.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242106

0 1
O -2.059945 0.533102 1.615599
N -3.588564 -1.376514 -0.899561
N -3.636408 -0.665195 0.352634
N 6.347983 0.365553 0.046026
N -0.008045 -0.763585 -0.423388
C -2.186458 -1.599119 -1.171305
C -1.405140 -0.857491 -0.312413
C -2.289718 -0.195314 0.680543
C -4.818570 0.112015 0.638388
C 4.959610 0.258622 0.129049
C 7.127730 1.209911 0.985441
C 7.126892 -0.336185 -1.004492
C -4.463102 -2.584665 -0.903350
C -1.767417 -2.452351 -2.298368
C 2.139656 0.035275 0.305285
C 4.241713 0.915819 1.166405
C 4.231434 -0.512036 -0.816888
C -4.963138 0.587385 1.957157
C -5.809112 0.364913 -0.325706
C 2.861578 0.800677 1.242024
C 2.850600 -0.615982 -0.720658
C 0.680042 -0.055368 0.429847
C 7.540029 0.429057 2.234186
C 7.239879 0.499896 -2.280166
C -6.113441 1.295515 2.302487
C -6.956797 1.070004 0.045186
C -7.115945 1.532106 1.354419
H 8.028196 1.600355 0.460024
H 6.526191 2.104035 1.273682
H 8.139536 -0.571328 -0.606165
H 6.647585 -1.317801 -1.230754
H -5.489002 -2.306699 -0.599672
H -4.121511 -3.384159 -0.225965
H -4.508699 -2.973820 -1.933889
H -0.688484 -2.306327 -2.507359
H -2.312120 -2.216690 -3.225166
H -1.906410 -3.522038 -2.081511
H 4.767883 1.511230 1.906794
H 4.747878 -1.024715 -1.622905
H -4.170928 0.418620 2.690867
H -5.680197 0.036823 -1.355677
H 2.327935 1.313490 2.044838
H 2.299646 -1.211948 -1.453626
H 0.245300 0.509819 1.277545
H 8.183912 -0.423072 1.988690
H 6.665680 0.022421 2.760304
H 8.084217 1.067167 2.938424
H 6.249700 0.755690 -2.681323
H 7.762063 1.446924 -2.103093
H 7.784766 -0.040840 -3.061121
H -6.229062 1.667782 3.320273
H -7.728786 1.266181 -0.697957
H -8.011733 2.080852 1.634961


%chk=000242106-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242106

0 1
O -2.071253 0.629129 1.659136
N -3.577384 -1.377433 -0.874610
N -3.648788 -0.565938 0.305447
N 6.417405 0.367296 0.026341
N -0.035858 -0.733524 -0.402395
C -2.214066 -1.553976 -1.164978
C -1.424302 -0.810885 -0.284177
C -2.319930 -0.156926 0.694749
C -4.861478 0.104036 0.648083
C 5.025682 0.259328 0.130851
C 7.199151 1.220952 0.943026
C 7.178153 -0.361238 -1.008422
C -4.526191 -2.511972 -0.953187
C -1.742962 -2.443299 -2.272639
C 2.150171 0.035412 0.336505
C 4.302933 0.885850 1.199584
C 4.258642 -0.484998 -0.831199
C -5.076048 0.485875 1.997534
C -5.830845 0.410643 -0.343126
C 2.906811 0.774890 1.288534
C 2.867142 -0.592130 -0.723437
C 0.697815 -0.054582 0.466098
C 7.601953 0.512402 2.258350
C 7.267166 0.391272 -2.357649
C -6.262838 1.164763 2.344857
C -7.021509 1.072612 0.024436
C -7.245365 1.452284 1.368283
H 8.110901 1.545918 0.406905
H 6.629824 2.142700 1.164326
H 8.198538 -0.534759 -0.617155
H 6.734086 -1.362697 -1.157810
H -5.557758 -2.146343 -0.838566
H -4.322442 -3.269669 -0.170729
H -4.424604 -2.974791 -1.947258
H -0.658184 -2.282949 -2.382035
H -2.241635 -2.209605 -3.231393
H -1.909393 -3.516140 -2.054424
H 4.833353 1.450020 1.971759
H 4.756715 -0.968711 -1.676536
H -4.310161 0.268121 2.745009
H -5.630150 0.164488 -1.391264
H 2.383565 1.266130 2.119162
H 2.293744 -1.158074 -1.465322
H 0.239947 0.474903 1.321057
H 8.220744 -0.379396 2.050238
H 6.710878 0.181352 2.819139
H 8.187158 1.193840 2.903818
H 6.262755 0.569757 -2.778981
H 7.758005 1.372894 -2.227654
H 7.854625 -0.192651 -3.090742
H -6.421546 1.464608 3.386591
H -7.766264 1.307543 -0.744363
H -8.168006 1.971663 1.648833


