%chk=000179196.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179196

0 1
O 1.790602 0.266070 1.292009
O -3.023332 -0.322980 -0.367284
N 3.205197 0.802020 -0.469530
N 1.762180 2.443970 0.489547
C 3.953604 -0.509593 -0.458994
C 2.948336 -1.644727 -0.696450
C 4.977317 -0.444869 -1.607378
C 4.669409 -0.689362 0.887907
C 2.217994 1.085467 0.489675
C 0.545260 2.727976 1.294785
C -0.727182 2.451783 0.525224
C -1.204674 1.136331 0.444696
C -1.414565 3.497836 -0.102736
C -2.380879 0.905751 -0.271408
C -2.593956 3.235704 -0.813145
C -3.091357 1.938776 -0.910630
C -2.318597 -1.515717 -0.172294
C -1.044905 -1.749980 -0.699428
C -3.058164 -2.503112 0.495283
C -0.497891 -3.027103 -0.543184
C -2.488753 -3.769692 0.630824
C -1.212578 -4.032531 0.116503
H 2.406085 -1.516747 -1.638466
H 3.444061 -2.618782 -0.717082
H 2.196463 -1.671796 0.111472
H 5.726293 0.339006 -1.456289
H 5.522401 -1.393335 -1.686171
H 4.495520 -0.273534 -2.576678
H 3.940493 -0.716675 1.715021
H 5.367793 0.124941 1.099835
H 5.229839 -1.627935 0.922154
H 3.662233 1.570463 -0.954647
H 0.604316 3.790996 1.622368
H 0.575311 2.109199 2.228927
H 1.781867 2.949944 -0.396930
H -0.663084 0.325747 0.941859
H -1.042796 4.516939 -0.036993
H -3.126951 4.055107 -1.295967
H -4.005022 1.710790 -1.454265
H -0.497076 -0.964867 -1.215135
H -4.046298 -2.271958 0.886011
H 0.494523 -3.238143 -0.941604
H -3.040598 -4.556621 1.144428
H -0.775639 -5.021758 0.232859


%chk=000179196-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179196

0 1
O 1.960122 0.353076 1.489001
O -3.208858 -0.287405 -0.157950
N 3.326068 0.707869 -0.395628
N 1.697217 2.291210 0.200977
C 4.113982 -0.561498 -0.319428
C 3.166088 -1.780524 -0.463553
C 5.108503 -0.522585 -1.505805
C 4.889279 -0.635248 1.023219
C 2.312576 1.062493 0.490618
C 0.593787 2.796628 1.037115
C -0.789627 2.540184 0.440701
C -1.299244 1.216439 0.410118
C -1.563751 3.604372 -0.081818
C -2.569872 0.976696 -0.156731
C -2.839370 3.348539 -0.639423
C -3.347607 2.035281 -0.683207
C -2.483334 -1.506273 -0.146573
C -1.270264 -1.694733 -0.849084
C -3.105821 -2.577228 0.531922
C -0.672863 -2.974830 -0.850213
C -2.500786 -3.852358 0.514747
C -1.280592 -4.056701 -0.171940
H 2.635063 -1.743021 -1.432984
H 3.747908 -2.719418 -0.417951
H 2.422990 -1.783441 0.350326
H 5.795043 0.342454 -1.426143
H 5.723367 -1.438809 -1.510038
H 4.574510 -0.466437 -2.473394
H 4.180940 -0.611928 1.867227
H 5.584027 0.219406 1.119315
H 5.476832 -1.570518 1.073289
H 3.641607 1.399264 -1.078417
H 0.738015 3.880445 1.204669
H 0.693606 2.279397 2.007434
H 1.836280 2.726034 -0.712722
H -0.704808 0.404080 0.842289
H -1.174717 4.629242 -0.046108
H -3.439615 4.172989 -1.039618
H -4.332222 1.810823 -1.103942
H -0.803937 -0.863216 -1.385949
H -4.048024 -2.394680 1.057296
H 0.270559 -3.123987 -1.387348
H -2.980971 -4.683950 1.042164
H -0.809284 -5.045131 -0.177759


