%chk=000228376.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228376

0 1
N 3.744142 -0.194518 -0.320929
N -0.969900 1.162283 2.936453
C 1.333883 0.203469 0.008858
C 2.392011 -0.837312 -0.401494
C -0.074121 -0.394775 -0.046060
C -1.153568 0.628221 0.378619
C 4.049502 0.577784 -1.572077
C 4.818359 -1.198804 -0.022028
C -2.534805 0.100797 0.034612
C 5.148033 1.605236 -1.294290
C 4.734068 -1.635045 1.441445
C -3.131035 -0.907393 0.805916
C -3.209376 0.614794 -1.081938
C -1.053631 0.923762 1.809479
C -4.394988 -1.394070 0.462389
C -4.472814 0.122582 -1.422008
C -5.067571 -0.881348 -0.651644
H 1.405104 1.095510 -0.643029
H 1.566988 0.571204 1.030335
H 2.164938 -1.249600 -1.406995
H 2.350989 -1.696266 0.304780
H -0.136651 -1.293995 0.598490
H -0.300825 -0.746408 -1.072890
H -0.972622 1.592798 -0.177923
H 4.341846 -0.075794 -2.422007
H 3.125454 1.112989 -1.886926
H 4.778953 -2.085183 -0.690804
H 5.804616 -0.711729 -0.197876
H 4.906069 2.202388 -0.403745
H 6.116346 1.129650 -1.101628
H 5.270155 2.290594 -2.138404
H 4.696414 -0.760264 2.106214
H 3.833552 -2.225083 1.645056
H 5.603385 -2.236321 1.724390
H -2.614144 -1.308168 1.677564
H -2.755808 1.397833 -1.686819
H -4.857353 -2.173841 1.066437
H -4.995156 0.524896 -2.288869
H -6.052438 -1.261473 -0.916754


%chk=000228376-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000228376

0 1
N 3.783690 -0.219445 -0.347787
N -0.921190 1.047086 3.074391
C 1.342366 0.208532 0.109258
C 2.411902 -0.787991 -0.390858
C -0.087217 -0.347365 -0.059464
C -1.204240 0.628350 0.451094
C 4.075636 0.641865 -1.526081
C 4.832670 -1.248245 -0.110601
C -2.604174 0.111597 0.086374
C 5.164348 1.696427 -1.249601
C 4.884341 -1.722992 1.354242
C -3.361351 -0.692647 0.972248
C -3.123524 0.395582 -1.201377
C -1.055610 0.867470 1.902384
C -4.615997 -1.207133 0.574381
C -4.377149 -0.117786 -1.600225
C -5.127499 -0.923667 -0.712570
H 1.433185 1.164249 -0.446010
H 1.550323 0.439955 1.170283
H 2.145116 -1.138013 -1.422231
H 2.383291 -1.684023 0.256772
H -0.194004 -1.313732 0.470589
H -0.295343 -0.546414 -1.129079
H -1.044614 1.604238 -0.052601
H 4.361057 0.026925 -2.418597
H 3.141618 1.167604 -1.798714
H 4.703633 -2.128353 -0.791893
H 5.809187 -0.798054 -0.365586
H 4.862362 2.340616 -0.405771
H 6.133450 1.232314 -0.991960
H 5.324810 2.329716 -2.142332
H 5.066425 -0.863994 2.022838
H 3.939094 -2.201891 1.668378
H 5.695476 -2.462153 1.493683
H -2.978031 -0.905073 1.977213
H -2.549060 1.025693 -1.892606
H -5.195134 -1.824046 1.270424
H -4.769864 0.114323 -2.596423
H -6.101976 -1.320125 -1.018286


