%chk=000207805.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207805

0 1
O -3.467986 0.955217 -0.070106
O -3.643661 -3.661375 -0.111826
N -0.510516 0.665658 0.816225
N -1.632468 -2.725243 0.500608
N 0.411181 -1.412203 1.124360
N -3.553817 -1.347087 -0.107350
N 0.684642 4.711680 -1.739065
N 4.141402 -0.475081 -1.322922
C -1.507373 -0.282778 0.510720
C -0.697834 2.123853 0.695026
C 0.629966 -0.050269 1.170900
C -0.906124 -1.556033 0.710225
C -0.063521 2.653844 -0.597674
C 1.930322 0.553864 1.578590
C -2.877029 -0.095309 0.098217
C -2.995200 -2.649463 0.074873
C -0.252413 4.174745 -0.707712
C 2.887817 0.654228 0.423612
C -0.992919 -4.048887 0.696607
C -4.970361 -1.310913 -0.566238
C 3.445908 1.881242 0.043980
C 3.265681 -0.505302 -0.290541
C 4.349306 1.921056 -1.022229
C 4.673363 0.724484 -1.680093
H -1.800908 2.340704 0.699118
H -0.262052 2.622496 1.589979
H 1.019176 2.405594 -0.635403
H -0.510361 2.145733 -1.476675
H 2.389720 -0.088454 2.374668
H 1.773559 1.543569 2.060138
H 0.003276 4.669355 0.257072
H -1.320151 4.409556 -0.913363
H -1.732378 -4.856953 0.536394
H -0.589347 -4.128522 1.721928
H -0.159407 -4.180402 -0.016530
H -5.565835 -2.079131 -0.040993
H -5.027774 -1.507944 -1.650214
H -5.405763 -0.314585 -0.363187
H 3.181957 2.802025 0.564945
H 2.848923 -1.490358 -0.030587
H 0.519560 5.704612 -1.879310
H 0.531749 4.257986 -2.635603
H 4.788779 2.864564 -1.339112
H 5.377110 0.705928 -2.520050


%chk=000207805-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207805

0 1
O -3.210545 1.131639 -0.225594
O -3.845399 -3.540605 -0.104190
N -0.325228 0.531215 0.831264
N -1.750476 -2.726328 0.573064
N 0.355039 -1.612938 1.243547
N -3.495269 -1.222853 -0.157448
N 0.004140 4.378310 -2.331654
N 4.001986 0.097073 -1.615927
C -1.400403 -0.312514 0.500914
C -0.321600 2.003081 0.672369
C 0.707735 -0.291641 1.267774
C -0.946702 -1.613948 0.769251
C -0.116002 2.447475 -0.791673
C 2.064605 0.191190 1.701129
C -2.726260 -0.018782 0.023375
C -3.071306 -2.561361 0.093362
C -0.175104 3.983697 -0.921503
C 2.964687 0.636441 0.546399
C -1.239155 -4.080653 0.859192
C -4.883521 -1.085073 -0.655119
C 3.611523 1.895000 0.545272
C 3.198576 -0.222428 -0.560346
C 4.445491 2.246579 -0.540033
C 4.610011 1.321332 -1.595157
H -1.293326 2.379811 1.036891
H 0.477058 2.410600 1.317661
H 0.855387 2.091837 -1.179087
H -0.918021 1.999944 -1.409004
H 2.531058 -0.658628 2.230813
H 1.970600 1.014350 2.434757
H 0.650816 4.433422 -0.334793
H -1.131463 4.343053 -0.466442
H -2.044676 -4.794221 0.633481
H -0.945743 -4.157920 1.919449
H -0.356093 -4.291764 0.233175
H -5.590432 -1.516132 0.072326
H -4.998527 -1.625486 -1.608917
H -5.076581 -0.011380 -0.793279
H 3.467033 2.590049 1.381847
H 2.721305 -1.209116 -0.602822
H 0.148567 5.381986 -2.476628
H -0.716151 4.002436 -2.957179
H 4.955395 3.214493 -0.572061
H 5.245173 1.554461 -2.457055


