%chk=000250657.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250657

0 1
O 3.373115 -1.175707 0.151337
O -4.204781 1.244449 0.015505
N 2.295324 0.879653 -0.078378
N -3.118388 -0.790125 -0.001353
N 4.660017 0.746251 0.124562
C 0.938150 0.421158 -0.031166
C -1.758205 -0.337662 -0.010673
C -0.074306 1.402516 -0.003817
C 0.595070 -0.942680 -0.044148
C -1.414403 1.025668 0.004284
C -0.744640 -1.318460 -0.033979
C 3.431429 0.038988 0.055801
C -4.265434 0.030863 0.011788
C -5.558763 -0.738215 0.020299
C 5.900801 -0.057351 0.020838
H 0.176055 2.461794 0.009787
H 1.377864 -1.711403 -0.057212
H -2.196920 1.794341 0.023299
H -0.995742 -2.377780 -0.043436
H 2.416491 1.891354 -0.018160
H -3.241276 -1.803582 -0.004232
H 4.730527 1.676948 -0.277801
H -5.680944 -1.368400 -0.870084
H -6.407950 -0.033194 0.030380
H -5.665251 -1.374739 0.908248
H 6.688448 0.426031 0.622738
H 6.251767 -0.170407 -1.017047
H 5.735346 -1.074307 0.432319


%chk=000250657-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250657

0 1
O 3.460620 -1.298366 0.038526
O -4.305803 1.326117 -0.045743
N 2.330382 0.777584 -0.030733
N -3.164415 -0.725583 0.020107
N 4.671677 0.701416 -0.027435
C 0.971119 0.359495 -0.016809
C -1.799409 -0.311378 0.005402
C -0.028694 1.368280 -0.047004
C 0.569477 -1.002680 0.024817
C -1.399098 1.050362 -0.036532
C -0.800773 -1.319794 0.035319
C 3.480849 -0.030354 -0.003600
C -4.317850 0.059580 -0.003555
C -5.615322 -0.752046 0.026705
C 5.973146 0.028393 -0.006269
H 0.266017 2.425891 -0.079483
H 1.330625 -1.784141 0.048142
H -2.159468 1.832481 -0.059879
H -1.095828 -2.377322 0.067820
H 2.465732 1.790138 -0.064182
H -3.309331 -1.737748 0.053542
H 4.653126 1.720883 -0.062118
H -5.689162 -1.427758 -0.845759
H -6.463671 -0.053275 0.004066
H -5.685778 -1.365623 0.944209
H 6.567333 0.322109 0.879380
H 6.557863 0.244641 -0.920228
H 5.780036 -1.055299 0.040991


