%chk=000241472.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241472

0 1
O 1.318527 3.266900 0.212321
O -1.393221 1.865141 -1.824286
N 0.310201 -0.099170 -0.376870
C 1.228070 0.838478 -1.089090
C -0.608232 0.589029 0.574344
C 2.381165 1.202456 -0.183878
C -2.048496 0.714947 0.137295
C 3.476190 0.309307 0.061367
C -3.109833 0.214805 0.967324
C -0.118046 -1.285462 -1.022903
C 4.563253 0.740598 0.873066
C -4.461799 0.339549 0.544110
C 2.407128 2.444558 0.431306
C -2.402778 1.336838 -1.049560
C 3.520710 -1.016619 -0.482710
C -2.856450 -0.408019 2.234688
C 4.543679 2.044348 1.459569
C -4.760419 0.966592 -0.706313
C 3.484000 2.889087 1.252433
C -3.755385 1.463693 -1.491923
C 0.375953 -1.656329 -2.296199
C -0.972707 -2.187633 -0.339863
C 5.669066 -0.140277 1.101217
C -5.514349 -0.162237 1.374272
C 4.590226 -1.840690 -0.243886
C -3.882596 -0.877776 3.012886
C 5.685430 -1.397213 0.554399
C -5.234636 -0.756144 2.578321
C 0.038456 -2.890031 -2.850979
C -1.299445 -3.411556 -0.914276
C -0.797787 -3.776739 -2.169961
H 0.680554 1.765293 -1.405308
H 1.619013 0.383261 -2.029685
H -0.210249 1.617664 0.777260
H -0.537398 0.034261 1.544075
H 2.674252 -1.372015 -1.073920
H -1.818638 -0.500526 2.567941
H 5.386582 2.353632 2.078483
H -5.802035 1.043377 -1.020121
H 3.449662 3.878583 1.697768
H -3.963676 1.946729 -2.442321
H 1.015947 -0.975792 -2.855394
H -1.372886 -1.933263 0.637133
H 6.494270 0.210167 1.719354
H -6.542501 -0.061489 1.028077
H 4.617344 -2.849345 -0.655217
H -3.682280 -1.350887 3.973773
H 6.521295 -2.073181 0.721675
H -6.028833 -1.140262 3.214851
H 0.430392 -3.159739 -3.831088
H -1.955812 -4.096146 -0.377292
H -1.058595 -4.734423 -2.606724
H 1.433997 4.148941 0.639511
H -1.740479 2.257828 -2.661952


%chk=000241472-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241472

0 1
O 1.512606 3.532722 -0.305894
O -1.574225 1.962471 -1.907577
N 0.245786 0.034827 -0.822959
C 1.309700 0.914679 -1.360433
C -0.522122 0.588124 0.314469
C 2.378790 1.279462 -0.326812
C -2.034117 0.706565 0.097849
C 3.338326 0.312458 0.156010
C -3.000990 0.179329 1.035759
C -0.051487 -1.226995 -1.362473
C 4.354322 0.713697 1.112766
C -4.423520 0.335547 0.773908
C 2.461190 2.593716 0.161218
C -2.516609 1.394282 -1.029133
C 3.334204 -1.056298 -0.283148
C -2.629585 -0.508141 2.245723
C 4.387181 2.071013 1.569768
C -4.848291 1.019421 -0.408990
C 3.459114 2.997515 1.104513
C -3.913099 1.544742 -1.294153
C 0.439946 -1.647904 -2.640672
C -0.863410 -2.159063 -0.638774
C 5.310512 -0.245424 1.582267
C -5.385914 -0.190359 1.696839
C 4.280633 -1.968488 0.191280
C -3.590344 -1.007614 3.128256
C 5.279797 -1.566126 1.131939
C -4.985289 -0.852712 2.857063
C 0.148985 -2.931588 -3.147245
C -1.150827 -3.434578 -1.161412
C -0.646442 -3.844368 -2.417906
H 0.850613 1.839817 -1.747658
H 1.801910 0.405413 -2.202812
H -0.118316 1.600939 0.491724
H -0.311818 0.005734 1.230492
H 2.572428 -1.399798 -0.988316
H -1.573406 -0.637859 2.500221
H 5.154545 2.372860 2.291897
H -5.920496 1.128566 -0.607294
H 3.486174 4.037278 1.457273
H -4.239600 2.077529 -2.197322
H 1.019639 -0.964683 -3.268807
H -1.269676 -1.893607 0.339692
H 6.070769 0.078915 2.303389
H -6.451441 -0.060160 1.471514
H 4.253476 -3.006541 -0.158261
H -3.271036 -1.524961 4.039938
H 6.013535 -2.294362 1.494281
H -5.727300 -1.251294 3.557028
H 0.541394 -3.211776 -4.132440
H -1.775177 -4.117504 -0.572647
H -0.872427 -4.838150 -2.818089
H 1.677971 4.420622 0.096504
H -2.030780 2.405214 -2.665254


