%chk=000180263.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180263

0 1
O -3.746600 -3.141601 -0.074860
O -5.683170 -1.611776 -0.140554
O -1.041165 -2.291988 0.023080
O -5.189050 1.380685 -0.063031
N 0.935053 2.505737 0.235684
C -3.354601 -1.875246 0.485957
C -4.562622 -0.915096 0.402074
C -2.140861 -1.470594 -0.394497
C -4.276924 0.343664 -0.456613
C -1.809434 -0.004199 -0.221771
C -2.879300 0.869707 -0.232990
C -0.471979 0.509692 -0.087735
C -2.696089 2.279242 -0.059871
C -0.301246 1.923844 0.088443
C 0.704204 -0.277507 -0.130770
C -1.446506 2.797317 0.106539
C 1.961002 0.296527 0.016013
C 2.032619 1.725897 0.205897
C 3.203025 -0.474107 -0.014479
C 4.440091 0.196202 0.140425
C 3.333086 2.370137 0.365296
C 4.467730 1.639474 0.331907
C 3.202341 -1.877526 -0.193064
C 5.645357 -0.542835 0.110093
C 4.392959 -2.587448 -0.220187
C 5.622517 -1.917479 -0.068654
H -3.026504 -2.027582 1.538694
H -4.923660 -0.609183 1.413803
H -2.347766 -1.698942 -1.470285
H -4.445583 0.129859 -1.539934
H -3.588282 2.915280 -0.056068
H 0.622136 -1.363490 -0.285305
H -1.272644 3.865985 0.251074
H -4.473491 -3.537477 0.465313
H -1.298387 -3.243025 -0.071819
H -5.421868 -2.107204 -0.959395
H -6.115214 1.062518 -0.173905
H 3.332645 3.452877 0.508994
H 5.445260 2.110302 0.448812
H 2.251915 -2.401775 -0.307615
H 6.594668 -0.021793 0.229050
H 4.384176 -3.667741 -0.358181
H 6.550963 -2.485531 -0.092065


%chk=000180263-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180263

0 1
O -3.818184 -3.170453 -0.094391
O -5.821640 -1.455421 0.236928
O -1.135539 -2.405639 -0.454691
O -5.309475 1.362530 -0.282580
N 0.940028 2.535976 0.244506
C -3.344618 -1.862796 0.433199
C -4.518881 -0.831741 0.500559
C -2.226892 -1.436353 -0.555807
C -4.294165 0.337497 -0.491540
C -1.819062 0.015582 -0.308849
C -2.904892 0.912925 -0.294040
C -0.476285 0.520942 -0.131019
C -2.716491 2.315207 -0.089192
C -0.296103 1.957846 0.070732
C 0.703927 -0.279169 -0.148672
C -1.436619 2.827389 0.090263
C 1.977727 0.296435 0.024267
C 2.044781 1.737186 0.223077
C 3.222733 -0.484844 0.012490
C 4.477436 0.197959 0.199260
C 3.332210 2.376588 0.406827
C 4.494969 1.636849 0.394969
C 3.245220 -1.898575 -0.176828
C 5.695123 -0.545366 0.190672
C 4.453845 -2.613193 -0.182215
C 5.690265 -1.934765 0.002630
H -2.888090 -2.002452 1.430324
H -4.602405 -0.403315 1.513048
H -2.670263 -1.510547 -1.577239
H -4.392487 -0.079232 -1.523773
H -3.601988 2.955196 -0.077545
H 0.582571 -1.351218 -0.298608
H -1.251821 3.894133 0.246247
H -4.151736 -3.726819 0.653166
H -1.549872 -3.296555 -0.599594
H -5.657604 -2.203768 -0.400687
H -6.186340 0.897006 -0.259038
H 3.329466 3.460826 0.552294
H 5.465795 2.127509 0.534508
H 2.307629 -2.444355 -0.321837
H 6.641383 -0.010131 0.334266
H 4.444504 -3.698667 -0.330036
H 6.630643 -2.496409 -0.002552


