%chk=000265614.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265614

0 1
O -2.598654 -2.650367 -0.314800
O -5.080278 1.245519 -0.427983
N -0.161318 -0.870955 0.400794
N -0.393507 1.400027 0.590864
N -2.846424 1.476752 0.073805
N -3.839672 -0.708666 -0.370793
C 4.278980 0.589839 0.018585
C 4.878408 -0.647554 0.724893
C 5.118230 0.766139 -1.267891
C 6.351402 -0.724359 0.282869
C 6.507784 0.185304 -0.952370
C 2.782409 0.449963 -0.293740
C 1.929463 0.467233 0.983760
C 0.482003 0.334637 0.665162
C -1.512312 -0.571775 0.143001
C -1.621580 0.841598 0.268800
C 0.401887 -2.222270 0.388343
C -2.615058 -1.439949 -0.186969
C -4.003554 0.705838 -0.255171
C -2.953694 2.949635 0.207929
C -5.073041 -1.468663 -0.716058
H 4.432603 1.483659 0.668776
H 4.342508 -1.566078 0.431766
H 4.789478 -0.567793 1.819216
H 5.176445 1.824182 -1.567563
H 4.661372 0.227733 -2.116263
H 7.021413 -0.393379 1.094544
H 6.638744 -1.762855 0.050205
H 6.906390 -0.375731 -1.813411
H 7.231398 0.993219 -0.748746
H 2.595390 -0.475904 -0.870023
H 2.463521 1.282700 -0.955653
H 2.091889 1.426740 1.530895
H 2.252425 -0.332621 1.682223
H 1.237771 -2.297551 -0.329780
H 0.764698 -2.509840 1.391452
H -0.376045 -2.962989 0.086756
H -3.994058 3.275133 0.016208
H -2.282101 3.447881 -0.513903
H -2.661190 3.261948 1.226375
H -4.843875 -2.549117 -0.781277
H -5.475115 -1.128411 -1.685983
H -5.848534 -1.312552 0.053655


%chk=000265614-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000265614

0 1
O -2.745818 -2.706116 -0.318889
O -5.116908 1.371024 -0.386995
N -0.237669 -0.963562 0.380190
N -0.399377 1.307612 0.578126
N -2.821500 1.473335 0.094320
N -3.908679 -0.638236 -0.345843
C 4.278127 0.533251 -0.079250
C 4.940372 -0.657407 0.667527
C 5.151311 0.646018 -1.357014
C 6.470514 -0.483184 0.426905
C 6.605093 0.401469 -0.862717
C 2.773234 0.366024 -0.372545
C 1.906427 0.309029 0.920483
C 0.436414 0.226550 0.641511
C -1.581304 -0.626634 0.137223
C -1.637799 0.770568 0.265907
C 0.316264 -2.329674 0.388610
C -2.723476 -1.439954 -0.182869
C -4.012374 0.778143 -0.221281
C -2.847858 2.941129 0.241361
C -5.171977 -1.336204 -0.678057
H 4.421249 1.454825 0.526344
H 4.584957 -1.604663 0.211351
H 4.688626 -0.693413 1.742940
H 5.032195 1.616305 -1.872331
H 4.848590 -0.146809 -2.071181
H 6.942784 0.020503 1.290203
H 6.973380 -1.460100 0.312764
H 7.225344 -0.083485 -1.637328
H 7.091646 1.363475 -0.617009
H 2.621561 -0.555985 -0.971353
H 2.415128 1.210829 -0.992626
H 2.079608 1.227561 1.508431
H 2.225282 -0.548768 1.542763
H 1.142312 -2.416591 -0.337350
H 0.689604 -2.590252 1.394617
H -0.490400 -3.025740 0.110878
H -3.879071 3.275020 0.056472
H -2.159157 3.406003 -0.483772
H -2.531005 3.225243 1.258868
H -4.944337 -2.410005 -0.744838
H -5.569370 -0.963369 -1.636172
H -5.925340 -1.147466 0.104125


