%chk=000199233.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000199233

0 1
O 1.189976 -1.226411 -0.190913
N -2.944185 0.368218 -0.463905
N 2.071103 0.704850 -1.248299
N 3.038389 -0.274821 0.747714
C -4.287333 -1.126268 0.973710
C -2.881372 -1.735697 0.821313
C -4.347295 0.044576 -0.033170
C -2.180953 -0.912179 -0.281404
C -2.384642 1.503869 0.353422
C -1.016208 1.758406 -0.035359
C 1.516837 2.016959 -0.769651
C 0.132280 1.927013 -0.363337
C 2.032382 -0.335074 -0.211814
C 1.401642 0.231763 -2.497182
C 3.085695 -1.321444 1.794184
C 4.202711 0.630821 0.676674
H -5.073129 -1.869002 0.763675
H -4.457186 -0.775224 2.003969
H -2.319384 -1.682762 1.768112
H -2.927058 -2.801786 0.548127
H -4.889934 -0.258577 -0.954815
H -4.876777 0.922086 0.374989
H -1.103755 -0.748690 -0.065066
H -2.221201 -1.441512 -1.257162
H -3.013826 2.404844 0.141696
H -2.435672 1.318370 1.454831
H 2.152062 2.376288 0.077088
H 1.640611 2.757924 -1.598336
H 0.323424 0.025462 -2.370161
H 1.884820 -0.700387 -2.833706
H 1.529479 0.990679 -3.283003
H 3.924246 -2.017394 1.629234
H 2.148752 -1.915203 1.783303
H 3.188988 -0.858781 2.788529
H 4.321263 1.055498 -0.337890
H 5.135726 0.093361 0.915981
H 4.086524 1.461625 1.393223


%chk=000199233-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000199233

0 1
O 1.818400 -1.642604 -0.528149
N -3.052939 0.351616 -0.495907
N 2.090420 0.600998 -1.220752
N 3.212657 -0.233450 0.718398
C -4.484381 -0.958533 1.017879
C -3.117000 -1.703581 0.853036
C -4.482422 0.105213 -0.136375
C -2.436293 -1.006333 -0.377832
C -2.424646 1.368834 0.407896
C -1.017273 1.627243 0.054567
C 1.593944 1.883490 -0.638183
C 0.166327 1.804951 -0.245207
C 2.337433 -0.495042 -0.342368
C 1.442510 0.239179 -2.502608
C 3.339424 -1.243942 1.779517
C 4.252223 0.805577 0.685294
H -5.346146 -1.643341 0.930837
H -4.551396 -0.469915 2.006661
H -2.495792 -1.597397 1.760081
H -3.251906 -2.784320 0.673490
H -4.990551 -0.309114 -1.027557
H -4.989169 1.048512 0.132392
H -1.339303 -0.936731 -0.296117
H -2.669472 -1.565694 -1.303191
H -3.004924 2.305634 0.301754
H -2.470816 1.081700 1.489159
H 2.202671 2.152766 0.240489
H 1.738393 2.680053 -1.393173
H 0.354589 0.065227 -2.388999
H 1.898048 -0.684295 -2.889589
H 1.604137 1.060608 -3.223583
H 4.277219 -1.826454 1.671814
H 2.492717 -1.942425 1.707883
H 3.339477 -0.755103 2.772161
H 4.278284 1.273242 -0.311482
H 5.241777 0.345170 0.879058
H 4.090776 1.589660 1.453308


