%chk=000180255.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180255

0 1
O -2.117392 1.176278 -0.376446
N -3.595915 1.146504 1.440520
N -5.379401 -0.499636 1.511035
C -0.319150 2.642438 -0.722366
C 0.958104 1.893002 -0.458507
C -1.419121 2.310643 0.278121
C 3.339347 0.476861 0.001475
C 2.162551 2.583821 -0.267142
C 0.949800 0.489298 -0.418062
C 3.347357 1.879087 -0.040786
C 2.130785 -0.214470 -0.187161
C 4.593590 -0.269142 0.243954
C -3.826006 -0.468682 -0.396583
C -3.182441 0.645067 0.262800
C -4.949342 -1.019657 0.286966
C 5.697114 -0.088253 -0.605097
C 4.685356 -1.161216 1.324345
C -3.413486 -1.019468 -1.638772
C -5.645479 -2.123092 -0.291936
C -4.100725 -2.083490 -2.176826
C 6.879530 -0.795716 -0.373889
C 5.871844 -1.863018 1.551658
C -5.222540 -2.635426 -1.496290
C 6.969573 -1.682642 0.703837
C -4.705292 0.531530 2.022899
H -0.676253 2.400483 -1.752528
H -0.147685 3.739050 -0.727076
H -2.152488 3.123437 0.411588
H -1.051180 1.962012 1.258418
H 2.182240 3.671602 -0.292533
H 0.009691 -0.046027 -0.563839
H 4.280637 2.420375 0.111127
H 2.120021 -1.303659 -0.158530
H 5.626890 0.598444 -1.446956
H 3.832957 -1.299338 1.987638
H -2.550714 -0.579026 -2.142178
H -6.503267 -2.533447 0.243807
H -3.797785 -2.517819 -3.128238
H 7.732762 -0.655840 -1.035576
H 5.941247 -2.551909 2.391995
H -5.745520 -3.479016 -1.950297
H 7.891964 -2.231399 0.882433
H -5.028378 0.956053 2.987495


%chk=000180255-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180255

0 1
O -2.021915 1.306929 -0.499445
N -3.691581 1.601563 1.138665
N -5.325380 -0.157163 1.598703
C -0.338652 2.964665 -1.077257
C 0.886403 2.108168 -0.791612
C -1.530968 2.672680 -0.153182
C 3.177405 0.471088 -0.200454
C 1.851445 2.517396 0.163445
C 1.087916 0.868906 -1.449733
C 2.973488 1.715518 0.456401
C 2.210436 0.066776 -1.161728
C 4.364520 -0.379506 0.103159
C -3.562358 -0.499819 -0.118435
C -3.105528 0.833197 0.204414
C -4.711044 -0.956841 0.628323
C 5.614896 0.202899 0.451694
C 4.279201 -1.798830 0.051880
C -2.956727 -1.344864 -1.094003
C -5.229515 -2.261430 0.368416
C -3.484811 -2.620029 -1.328296
C 6.737521 -0.602529 0.738954
C 5.401256 -2.605794 0.336437
C -4.624586 -3.076499 -0.595161
C 6.637565 -2.012188 0.682244
C -4.784758 1.054374 1.794164
H -0.670173 2.834560 -2.124010
H -0.089796 4.035901 -0.946788
H -2.358392 3.388405 -0.307235
H -1.250516 2.685574 0.914894
H 1.721020 3.472349 0.688479
H 0.359972 0.536224 -2.198882
H 3.685490 2.045585 1.221335
H 2.356378 -0.869944 -1.711530
H 5.716670 1.294056 0.467560
H 3.319340 -2.273498 -0.181898
H -2.083013 -0.980498 -1.642432
H -6.100397 -2.589852 0.943371
H -3.025021 -3.275460 -2.075760
H 7.692501 -0.130772 0.996727
H 5.308733 -3.697136 0.298866
H -5.025543 -4.077052 -0.791353
H 7.509006 -2.638065 0.904157
H -5.246688 1.695554 2.551401


