%chk=000243502.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000243502

0 1
O 1.475766 1.815377 0.530748
O -1.468618 1.360976 -1.328678
O -0.639393 4.099470 -1.025028
N 0.452844 2.198336 -0.351071
N -0.673049 0.292278 0.586661
C 2.299121 -0.300964 -0.367028
C 2.589989 1.158048 -0.170924
C 2.605601 -1.220551 0.647017
C 1.702733 -0.745657 -1.555971
C -1.571864 -0.822789 0.636447
C -0.667307 1.262387 -0.429114
C 2.316396 -2.576237 0.470464
C 1.412388 -2.102094 -1.726133
C -1.276414 -1.843313 1.564891
C -2.719383 -0.901226 -0.170549
C 1.718571 -3.018091 -0.714507
C 0.378527 3.627792 -0.587284
C -2.143346 -2.929982 1.680119
C -3.569484 -2.000284 -0.038792
C -3.289478 -3.014532 0.882496
C 1.636330 4.383474 -0.298249
H 3.401560 1.348094 0.559472
H 2.814040 1.683875 -1.114050
H 3.069672 -0.882148 1.571607
H 1.452381 -0.033891 -2.343597
H 0.120173 0.274183 1.243836
H 2.556041 -3.289890 1.257271
H 0.940058 -2.443969 -2.646979
H -0.384553 -1.792386 2.183774
H -2.947693 -0.112529 -0.894810
H 1.487573 -4.074106 -0.847950
H -1.922643 -3.719234 2.398121
H -4.461642 -2.063125 -0.662543
H -3.959911 -3.864702 0.978916
H 2.120535 4.061886 0.637078
H 1.421104 5.461409 -0.215488
H 2.369777 4.261315 -1.108673


%chk=000243502-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000243502

0 1
O 1.450859 1.783820 0.660967
O -1.420064 1.258418 -1.502262
O -0.570191 4.023412 -1.335243
N 0.428337 2.158119 -0.319447
N -0.764284 0.334600 0.573730
C 2.382114 -0.317941 -0.409860
C 2.642613 1.115404 -0.024534
C 2.602156 -1.360817 0.528061
C 1.898090 -0.642311 -1.703380
C -1.650961 -0.767520 0.715008
C -0.677729 1.215296 -0.492742
C 2.331826 -2.702816 0.184245
C 1.624756 -1.984274 -2.047600
C -1.471307 -1.602520 1.851487
C -2.693474 -1.049120 -0.208297
C 1.840278 -3.016141 -1.104926
C 0.385860 3.544591 -0.681770
C -2.320016 -2.707230 2.062552
C -3.531271 -2.162686 0.016254
C -3.356498 -2.996932 1.144114
C 1.574344 4.369526 -0.203516
H 3.412293 1.208431 0.760663
H 2.909392 1.740168 -0.894493
H 2.990131 -1.119390 1.526031
H 1.723594 0.155391 -2.435409
H -0.047673 0.457580 1.296587
H 2.505257 -3.501385 0.913787
H 1.241802 -2.223211 -3.045300
H -0.665839 -1.385979 2.565137
H -2.834572 -0.401860 -1.075695
H 1.626156 -4.056722 -1.372083
H -2.171761 -3.340765 2.944173
H -4.333830 -2.374230 -0.699344
H -4.017177 -3.854827 1.308063
H 1.662468 4.336560 0.895626
H 1.413596 5.405284 -0.537195
H 2.527127 3.999280 -0.621891


