%chk=000271938.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271938

0 1
O 3.940759 1.102020 1.820159
O -1.008753 -0.530202 -2.497346
N -0.216568 0.435114 -0.530181
N 1.087362 0.097447 -0.793693
C -3.309223 -0.252184 -0.051133
C -4.593328 0.204780 0.349199
C -2.575981 0.526887 -1.004460
C -2.800248 -1.469827 0.504708
C -5.119445 1.410655 -0.213493
C -3.105473 1.679159 -1.537366
C -5.338726 -0.555198 1.306870
C -4.395457 2.126219 -1.134494
C -3.538574 -2.178479 1.418385
C -1.223053 0.062504 -1.470235
C -4.823304 -1.714520 1.828258
C 3.411253 0.079214 -0.219161
C 4.424315 0.432813 0.714088
C 3.800399 -0.604914 -1.378099
C 2.014405 0.439471 0.061596
C 5.768452 0.115756 0.497487
C 5.143851 -0.927314 -1.604640
C 6.118022 -0.568563 -0.672532
C 4.889560 1.512092 2.834237
H -1.823200 -1.833143 0.181239
H -6.107966 1.745937 0.101407
H -2.551791 2.261763 -2.276141
H -6.321570 -0.194632 1.608017
H -4.792840 3.040780 -1.573386
H -3.158032 -3.108025 1.841620
H -5.383793 -2.299780 2.555999
H -0.480216 0.938428 0.326117
H 3.038149 -0.888186 -2.112531
H 1.860218 0.988613 1.006172
H 6.536884 0.387790 1.212456
H 5.423227 -1.458969 -2.511686
H 7.163242 -0.820928 -0.851760
H 5.611675 2.218767 2.415011
H 5.379289 0.637327 3.271873
H 4.235975 2.004526 3.565838


%chk=000271938-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000271938

0 1
O 3.734110 0.625480 2.018653
O -0.988699 0.076439 -2.970098
N -0.250616 0.327675 -0.751539
N 1.083157 0.115518 -1.052881
C -3.190826 -0.099169 -0.036340
C -4.522749 0.297349 0.388903
C -2.641445 0.508227 -1.230462
C -2.514469 -1.116560 0.724043
C -5.267255 1.238271 -0.394858
C -3.424657 1.388755 -1.992269
C -5.086507 -0.281939 1.574282
C -4.736892 1.758836 -1.576626
C -3.097196 -1.670840 1.866719
C -1.243535 0.253988 -1.749285
C -4.387052 -1.239934 2.309011
C 3.376916 0.070823 -0.290697
C 4.300720 0.250273 0.787775
C 3.886767 -0.308681 -1.562234
C 1.944464 0.280835 -0.066189
C 5.687789 0.053223 0.589683
C 5.266176 -0.505846 -1.763516
C 6.164847 -0.324272 -0.685445
C 4.635719 0.831629 3.154430
H -1.546797 -1.495024 0.379424
H -6.269486 1.529395 -0.058487
H -3.000559 1.797242 -2.915260
H -6.089386 0.033486 1.886356
H -5.317545 2.460935 -2.183855
H -2.568580 -2.453496 2.421921
H -4.828470 -1.679026 3.210109
H -0.536460 0.596476 0.203624
H 3.168132 -0.440702 -2.377384
H 1.640081 0.582206 0.952660
H 6.396316 0.189504 1.411646
H 5.640976 -0.797542 -2.749825
H 7.239958 -0.475413 -0.833208
H 5.360056 1.643421 2.949453
H 5.180178 -0.098167 3.409225
H 3.982316 1.119825 3.990938


