%chk=000296778.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296778

0 1
O 2.160413 2.682949 1.713007
N 4.132278 1.478492 -0.221304
C 3.222001 0.767910 -1.174559
C 2.789244 2.068402 -0.496771
C 2.692976 -0.562815 -0.757032
C 1.846257 2.123152 0.687852
C 5.310956 2.176040 -0.771975
C 0.493628 1.517492 0.502372
C 2.992868 -1.114250 0.497090
C 1.879457 -1.273783 -1.655028
C 2.484055 -2.367515 0.848258
C 1.371066 -2.524184 -1.295555
C -0.079770 1.340582 -0.764519
C -0.221375 1.134398 1.648805
C 1.672871 -3.073824 -0.045026
C -1.355487 0.788148 -0.885887
C -1.491628 0.570045 1.530285
C -2.065152 0.395025 0.260835
C -3.413416 -0.202565 0.130450
C -4.440105 0.507561 -0.511435
C -3.668184 -1.481914 0.649062
C -5.711593 -0.059496 -0.630059
C -4.940682 -2.044882 0.522795
C -5.963464 -1.335310 -0.115074
H 3.431408 0.818852 -2.257467
H 2.689924 2.976510 -1.113221
H 6.145310 1.452612 -0.811419
H 5.597963 2.973055 -0.060639
H 5.195900 2.627278 -1.767267
H 3.626351 -0.560949 1.195317
H 1.638671 -0.854068 -2.628930
H 2.720717 -2.792667 1.822371
H 0.737325 -3.071481 -1.990987
H 0.467611 1.631533 -1.660777
H 0.227537 1.286398 2.634682
H 1.276816 -4.048565 0.231464
H -1.799201 0.649604 -1.870552
H -2.042426 0.272452 2.421792
H -4.246019 1.502625 -0.909003
H -2.871132 -2.035708 1.143622
H -6.508057 0.494535 -1.124399
H -5.135780 -3.038570 0.923104
H -6.954434 -1.775208 -0.209981


%chk=000296778-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296778

0 1
O 2.172884 0.690640 1.874028
N 3.879114 1.599769 -0.306241
C 3.397505 0.523586 -1.216585
C 2.401235 1.444108 -0.422771
C 3.675087 -0.906615 -0.886363
C 1.614205 0.964163 0.770203
C 4.471163 2.805896 -0.930252
C 0.130748 0.802907 0.597574
C 4.146448 -1.293410 0.395653
C 3.469072 -1.899242 -1.880237
C 4.406520 -2.653084 0.670578
C 3.727083 -3.258717 -1.600633
C -0.517586 0.859370 -0.666239
C -0.660851 0.561281 1.752999
C 4.196649 -3.639692 -0.321823
C -1.910820 0.685705 -0.765884
C -2.051488 0.395301 1.651910
C -2.709378 0.455673 0.389165
C -4.184846 0.279641 0.279620
C -4.931417 0.971563 -0.714842
C -4.886793 -0.583923 1.166249
C -6.328586 0.806717 -0.819368
C -6.283791 -0.750948 1.061576
C -7.012705 -0.056121 0.068325
H 3.395910 0.749395 -2.298271
H 1.875682 2.168149 -1.067343
H 5.537711 2.608579 -1.132894
H 4.396426 3.644346 -0.216839
H 3.977995 3.106015 -1.885807
H 4.303451 -0.517185 1.150785
H 3.109547 -1.605813 -2.875267
H 4.771588 -2.944174 1.661880
H 3.567256 -4.016781 -2.375825
H 0.066599 1.003798 -1.581141
H -0.153131 0.514291 2.722108
H 4.399985 -4.694210 -0.103066
H -2.384098 0.692297 -1.753929
H -2.643149 0.246074 2.561766
H -4.419344 1.667888 -1.388649
H -4.331412 -1.152626 1.920401
H -6.884817 1.357468 -1.586119
H -6.802309 -1.429253 1.748274
H -8.097646 -0.184928 -0.012409


