%chk=000254052.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254052

0 1
O 0.483947 -0.275688 1.634609
N -3.316830 0.872012 1.324903
C 0.679322 -0.532827 0.217001
C 1.917527 -1.452883 0.090626
C -0.608472 -1.140956 -0.340785
C 3.141970 -0.871551 0.808605
C 0.960118 0.828208 -0.407686
C -1.862173 -0.525691 -0.133561
C 4.303929 -1.872703 0.839079
C -1.998132 0.784172 0.609378
C -0.553729 -2.322016 -1.098735
C 0.870325 0.985608 -1.798141
C 1.331140 1.916511 0.394092
C -3.018628 -1.111175 -0.680210
C -1.707402 -2.899686 -1.629448
C 5.528196 -1.288393 1.540503
C -2.948051 -2.291461 -1.416468
C 1.149643 2.225326 -2.379487
C 1.607105 3.154746 -0.191536
C 1.517938 3.311086 -1.578434
C -3.581526 2.285483 1.730755
C -3.321071 -0.018939 2.524368
H 2.154377 -1.612034 -0.979340
H 1.681015 -2.448797 0.512503
H 3.461635 0.065326 0.310520
H 2.860467 -0.576097 1.840294
H 4.572737 -2.170870 -0.193204
H 3.989824 -2.802872 1.351442
H -1.134345 0.947770 1.299790
H -1.946211 1.604416 -0.146366
H 0.400435 -2.811382 -1.292904
H 0.199159 -1.094531 2.086514
H 0.575565 0.144831 -2.425549
H 1.399639 1.786867 1.476788
H -3.985403 -0.624448 -0.518224
H -1.640242 -3.817148 -2.209494
H 5.305481 -1.012453 2.577626
H 5.890758 -0.386378 1.033944
H 6.354257 -2.007651 1.561616
H -3.853363 -2.733842 -1.828502
H 1.078515 2.345025 -3.459030
H 1.893768 3.997902 0.434104
H 1.734632 4.275203 -2.033579
H -3.650792 2.910695 0.826121
H -2.828202 2.725761 2.400166
H -4.560803 2.335153 2.232885
H -3.150132 -1.057531 2.196739
H -4.317125 0.016224 2.992114
H -2.568992 0.229176 3.287297


%chk=000254052-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000254052

0 1
O 0.534002 -0.421689 1.836916
N -3.414388 0.981208 1.173547
C 0.700084 -0.584982 0.359040
C 1.968344 -1.467871 0.124557
C -0.594812 -1.212622 -0.224181
C 3.266185 -0.901792 0.738637
C 0.956559 0.822860 -0.207060
C -1.870335 -0.575988 -0.063765
C 4.448619 -1.888793 0.606672
C -2.046740 0.782036 0.626661
C -0.541153 -2.443485 -0.931191
C 0.879937 1.034650 -1.606290
C 1.329793 1.900547 0.631541
C -3.021520 -1.193521 -0.611441
C -1.697800 -3.047528 -1.470284
C 5.762979 -1.321898 1.185606
C -2.949489 -2.417450 -1.308693
C 1.171888 2.301564 -2.158762
C 1.617729 3.169366 0.080220
C 1.542312 3.376051 -1.316786
C -3.727645 2.408373 1.382041
C -3.650084 0.180470 2.393143
H 2.117673 -1.601884 -0.965095
H 1.780234 -2.475098 0.552820
H 3.530854 0.052300 0.243769
H 3.093705 -0.665990 1.806967
H 4.596774 -2.145611 -0.462831
H 4.196163 -2.838648 1.122246
H -1.270062 0.909300 1.411007
H -1.868953 1.575677 -0.126148
H 0.417894 -2.948193 -1.073546
H 0.278026 -1.307414 2.199441
H 0.576135 0.210756 -2.263198
H 1.381936 1.734965 1.711137
H -3.976032 -0.675488 -0.465608
H -1.616529 -3.997293 -2.010960
H 5.651391 -1.083270 2.260139
H 6.053354 -0.390041 0.664989
H 6.596267 -2.041310 1.082928
H -3.857857 -2.869727 -1.723007
H 1.104821 2.451052 -3.242501
H 1.901966 3.995968 0.741748
H 1.765638 4.360474 -1.743573
H -3.618777 2.957186 0.429639
H -3.072023 2.903820 2.142746
H -4.774978 2.511708 1.719884
H -3.477628 -0.888292 2.177068
H -4.698950 0.298971 2.719900
H -2.983708 0.474071 3.243611


