%chk=000250617.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250617

0 1
O -0.354291 1.248305 -0.021253
N 0.695915 -0.822773 0.012663
N 1.941760 -0.257992 0.005962
C -5.470456 0.399374 -0.016893
C -4.272446 -0.560035 0.000278
C -6.800760 -0.364987 -0.006973
C -2.948091 0.211208 -0.009870
C -7.999064 0.594688 -0.024151
C -1.744474 -0.741522 0.007289
C -9.326815 -0.159427 -0.014365
C -0.447604 0.047805 -0.002783
C 4.336470 -0.412269 0.012374
C 2.995053 -1.030477 0.019756
C 5.463786 -1.254306 0.027537
C 4.512585 0.981766 -0.009199
C 6.746950 -0.704046 0.021118
C 5.800081 1.523619 -0.015480
C 6.918290 0.684366 -0.000377
H -5.417824 1.052332 -0.909943
H -5.420727 1.080290 0.855196
H -4.324460 -1.238912 -0.872796
H -4.327291 -1.210808 0.894325
H -6.853645 -1.044696 -0.879012
H -6.856544 -1.016736 0.885978
H -2.892261 0.897973 0.859875
H -2.889399 0.869873 -0.900895
H -7.946438 1.246851 -0.918021
H -7.949327 1.274882 0.848746
H -1.791070 -1.419353 -0.869640
H -1.794240 -1.391418 0.904950
H -10.175440 0.533869 -0.026270
H -9.428873 -0.786577 0.878507
H -9.426375 -0.813870 -0.887717
H 0.572269 -1.840716 0.028306
H 2.987852 -2.129906 0.036865
H 5.341739 -2.335158 0.044292
H 3.638904 1.639354 -0.021024
H 7.616850 -1.358415 0.032892
H 5.930394 2.604874 -0.032224
H 7.919816 1.109769 -0.005324


%chk=000250617-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250617

0 1
O -0.373284 1.514889 -0.041727
N 0.722254 -0.562101 0.006151
N 1.994997 -0.025472 -0.001521
C -5.558205 0.397163 -0.013195
C -4.289937 -0.485920 -0.006708
C -6.870863 -0.418236 -0.008135
C -2.983575 0.337734 -0.013448
C -8.139415 0.465350 -0.013856
C -1.728288 -0.555197 -0.004293
C -9.446493 -0.356823 -0.008908
C -0.425030 0.260792 -0.015915
C 4.395488 -0.390934 0.014873
C 3.007217 -0.868040 0.021320
C 5.455175 -1.339090 0.040978
C 4.709093 0.998999 -0.016809
C 6.800130 -0.912075 0.035795
C 6.052067 1.419785 -0.021892
C 7.103497 0.468484 0.004377
H -5.539903 1.057383 -0.905187
H -5.540543 1.069410 0.869778
H -4.310976 -1.158759 -0.890259
H -4.310676 -1.145213 0.887019
H -6.890401 -1.090094 -0.892011
H -6.890559 -1.078920 0.884133
H -2.956209 1.012078 0.863143
H -2.954867 0.995687 -0.902311
H -8.118931 1.125197 -0.905144
H -8.119237 1.136308 0.869091
H -1.742172 -1.231159 -0.884991
H -1.740256 -1.210549 0.891881
H -10.337730 0.297284 -0.013630
H -9.505087 -1.001815 0.888214
H -9.504334 -1.013692 -0.897416
H 0.587173 -1.586253 0.028384
H 2.860677 -1.969131 0.046189
H 5.222316 -2.411461 0.065485
H 3.885976 1.720476 -0.036822
H 7.608392 -1.651342 0.056167
H 6.286252 2.489862 -0.046409
H 8.147068 0.802194 0.000307


