%chk=000186746.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186746

0 1
S 0.025745 -2.642479 -0.691279
S 0.026221 2.642649 0.691877
N 1.817808 -0.653894 -0.287485
N 1.818009 0.653982 0.287032
N -0.320429 0.000106 0.000390
C 3.024936 -1.492450 -0.040389
C 3.025113 1.492429 0.039440
C 4.278542 -0.670271 -0.373140
C 4.278795 0.670116 0.371563
C 0.493466 -1.126669 -0.299523
C 0.493750 1.126877 0.299825
C -1.770153 0.000299 0.000508
C -2.453158 0.434059 1.147028
C -2.453495 -0.433274 -1.145855
C -3.850230 0.433476 1.133393
C -3.850580 -0.432232 -1.131975
C -4.547987 0.000746 0.000759
H 2.942370 -2.391785 -0.699311
H 3.047064 -1.851354 1.014214
H 2.942937 2.391732 0.698450
H 3.046780 1.851385 -1.015156
H 4.337704 -0.496683 -1.467641
H 5.180389 -1.257370 -0.109383
H 4.338486 0.496519 1.466035
H 5.180571 1.257122 0.107357
H -1.909686 0.773698 2.029262
H -1.910311 -0.773164 -2.028171
H -4.395963 0.772873 2.013468
H -4.396549 -0.771481 -2.011959
H -5.636948 0.000939 0.000866


%chk=000186746-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186746

0 1
S 0.030760 -2.744819 -0.603273
S 0.031333 2.745459 0.602735
N 1.808928 -0.674023 -0.232823
N 1.809086 0.674375 0.231744
N -0.295661 0.000357 -0.000305
C 3.021369 -1.498030 -0.084826
C 3.021773 1.498058 0.083929
C 4.271844 -0.656934 -0.409445
C 4.272004 0.656606 0.408599
C 0.503349 -1.138411 -0.298241
C 0.503619 1.139099 0.296970
C -1.738085 0.000394 0.000211
C -2.434411 0.460666 1.140010
C -2.435228 -0.459827 -1.139107
C -3.845735 0.462112 1.134091
C -3.846548 -0.461173 -1.132214
C -4.554861 0.000492 0.001184
H 2.896614 -2.357457 -0.763788
H 3.071484 -1.890635 0.951826
H 2.897194 2.357483 0.762924
H 3.072074 1.890713 -0.952696
H 4.296014 -0.425892 -1.491748
H 5.168533 -1.258960 -0.178961
H 4.296052 0.425550 1.490902
H 5.168871 1.258390 0.178171
H -1.878443 0.820096 2.010117
H -1.879887 -0.819293 -2.009599
H -4.388514 0.821727 2.014664
H -4.389958 -0.820750 -2.012413
H -5.650373 0.000525 0.001562


