%chk=000232163.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232163

0 1
O 0.037631 2.566971 0.964575
N -1.732319 1.545560 -0.267856
C -1.059550 -1.669971 0.072367
C -2.006229 -0.906675 -0.903113
C -2.655803 0.397723 -0.332144
C -1.763259 -1.841106 1.443348
C -1.309072 -0.692715 -2.256781
C -3.259767 0.141801 1.075304
C -2.258980 -0.517126 2.023550
C 0.299648 -0.995383 0.178802
C 0.061702 -0.014412 -2.169475
C -0.799020 -3.092573 -0.484567
C 0.832415 -0.272852 -0.904440
C -3.783091 0.867892 -1.278643
C 1.084022 -1.154781 1.331845
C 2.121556 0.278021 -0.811250
C 2.889944 0.126133 0.347306
C 2.359142 -0.600055 1.424509
C 4.272988 0.740198 0.460874
C -0.816338 1.942016 0.446967
C 4.187596 2.267027 0.343549
C 5.216151 0.147358 -0.593924
H -2.877146 -1.591542 -1.088482
H -1.074867 -2.331270 2.160494
H -2.615041 -2.539527 1.330816
H -1.964075 -0.095365 -2.923360
H -1.196899 -1.678495 -2.752693
H -4.156370 -0.499485 0.973187
H -3.627258 1.092939 1.506283
H -2.732865 -0.688775 3.009485
H -1.400900 0.156090 2.221023
H -0.071225 1.086620 -2.275196
H 0.673794 -0.321716 -3.043186
H -0.254407 -3.052623 -1.435441
H -0.180773 -3.676189 0.206400
H -1.726138 -3.645800 -0.652855
H -3.388701 1.107349 -2.275934
H -4.557525 0.105715 -1.395441
H -4.261548 1.782824 -0.907626
H 0.691348 -1.723907 2.176271
H 2.526734 0.842006 -1.649573
H 2.938691 -0.729817 2.335395
H 4.694548 0.498066 1.471376
H 3.868896 2.583522 -0.655537
H 5.154855 2.736550 0.546417
H 3.458310 2.676294 1.054845
H 5.259695 -0.944724 -0.515504
H 6.233826 0.533178 -0.474327
H 4.891575 0.388630 -1.611936


%chk=000232163-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000232163

0 1
O -0.923094 3.542238 0.852193
N -1.653755 1.428104 -0.116343
C -1.059323 -1.709023 0.084101
C -2.006843 -0.928653 -0.900732
C -2.661432 0.375735 -0.303070
C -1.790403 -1.901816 1.448085
C -1.298515 -0.720738 -2.263576
C -3.312355 0.067025 1.079711
C -2.323502 -0.592943 2.057753
C 0.314894 -1.009356 0.202727
C 0.049525 0.030323 -2.153380
C -0.793687 -3.143704 -0.480766
C 0.853679 -0.269726 -0.891333
C -3.750723 0.926703 -1.263958
C 1.128249 -1.179011 1.351388
C 2.161176 0.264453 -0.797229
C 2.971885 0.099602 0.350233
C 2.427321 -0.634737 1.431234
C 4.381336 0.692644 0.429113
C -1.355717 2.488311 0.403698
C 4.359053 2.240833 0.317099
C 5.321849 0.077518 -0.641941
H -2.878035 -1.596046 -1.078149
H -1.132421 -2.427436 2.164074
H -2.648444 -2.584723 1.270399
H -1.959319 -0.188975 -2.972560
H -1.127407 -1.718760 -2.707242
H -4.170889 -0.613368 0.907442
H -3.719179 1.009438 1.495325
H -2.831020 -0.799302 3.019373
H -1.485343 0.095962 2.275767
H -0.134728 1.121149 -2.180098
H 0.666135 -0.196489 -3.046154
H -0.174389 -3.127551 -1.393164
H -0.249509 -3.743962 0.271562
H -1.746501 -3.660311 -0.710148
H -3.310719 1.307037 -2.200537
H -4.478192 0.133326 -1.513650
H -4.294852 1.758248 -0.780629
H 0.749057 -1.745230 2.208802
H 2.548619 0.837003 -1.651439
H 3.024582 -0.781367 2.340134
H 4.793429 0.434372 1.425746
H 3.970076 2.561038 -0.667501
H 5.378860 2.654796 0.428618
H 3.713852 2.688437 1.094100
H 5.375163 -1.021785 -0.543055
H 6.345114 0.486378 -0.543930
H 4.962343 0.307940 -1.662390


