%chk=000200129.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200129

0 1
N 0.922151 -0.002952 -0.000119
N -0.035887 2.218346 -0.000459
N -0.520038 -1.944539 0.000059
N 3.325601 -0.282077 0.000042
C -5.396249 0.103047 -0.000510
C -3.950995 0.610567 -0.000397
C -1.538479 0.262390 -0.000275
C -0.379644 -0.637239 -0.000102
C -2.855911 -0.246833 -0.000274
C -1.331025 1.661859 -0.000450
C 1.023931 1.443460 -0.000309
C -6.102124 0.629466 -1.266253
C -6.103725 0.632685 1.262999
C -5.475822 -1.434546 0.001484
C 2.123263 -0.812411 0.000052
C -3.722534 2.009053 -0.000628
C 2.382436 1.995942 -0.000316
C -2.441835 2.535453 -0.000642
C 1.924241 -2.264712 0.000246
C 0.607476 -2.789227 0.000242
C 3.494529 1.117348 -0.000144
C 2.604186 3.390172 -0.000491
C 3.021803 -3.153423 0.000432
C 0.398745 -4.187820 0.000423
C 4.810171 1.634336 -0.000151
C 3.900157 3.887611 -0.000496
C 2.805650 -4.524193 0.000607
C 1.493730 -5.038657 0.000604
C 5.000757 3.008295 -0.000326
H -2.984332 -1.334736 -0.000203
H -7.128583 0.253877 -1.333089
H -6.156290 1.722088 -1.284947
H -5.576013 0.312131 -2.173601
H -6.158482 1.725327 1.278575
H -7.130079 0.256792 1.329784
H -5.578439 0.318134 2.171791
H -6.517600 -1.774187 0.001512
H -4.998406 -1.868664 -0.884017
H -4.999098 -1.866282 0.888523
H -4.577800 2.688488 -0.000798
H -2.268964 3.612394 -0.000810
H 1.744402 4.067716 -0.000622
H 4.038066 -2.746455 0.000431
H -0.622245 -4.571022 0.000418
H 5.652189 0.941182 -0.000022
H 4.072352 4.962785 -0.000629
H 3.650898 -5.210617 0.000744
H 1.343443 -6.119444 0.000745
H 6.012319 3.417394 -0.000333


%chk=000200129-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200129

0 1
N 0.934074 0.006272 -0.000079
N -0.010803 2.248563 -0.000756
N -0.534075 -1.935532 0.000347
N 3.349791 -0.295343 0.000166
C -5.413171 0.091444 -0.000670
C -3.959898 0.618689 -0.000623
C -1.516936 0.283886 -0.000333
C -0.363970 -0.619750 0.000000
C -2.838944 -0.233906 -0.000297
C -1.295986 1.694760 -0.000697
C 1.042285 1.443735 -0.000462
C -6.150141 0.611596 -1.272148
C -6.150575 0.612327 1.270240
C -5.478070 -1.457064 -0.000227
C 2.125669 -0.804259 0.000223
C -3.719870 2.031165 -0.000969
C 2.402039 1.990173 -0.000514
C -2.423090 2.560424 -0.001004
C 1.919871 -2.254868 0.000601
C 0.586334 -2.774616 0.000653
C 3.518290 1.094922 -0.000197
C 2.618676 3.392998 -0.000875
C 3.027445 -3.142928 0.000917
C 0.386364 -4.182465 0.001022
C 4.837854 1.623917 -0.000247
C 3.928361 3.902679 -0.000921
C 2.815216 -4.531875 0.001279
C 1.489688 -5.051646 0.001331
C 5.040430 3.014045 -0.000606
H -2.942218 -1.321098 0.000007
H -7.197407 0.254484 -1.275615
H -6.169773 1.715611 -1.313698
H -5.655958 0.245755 -2.190768
H -6.170323 1.716366 1.311113
H -7.197818 0.255145 1.273581
H -5.656676 0.247095 2.189254
H -6.535216 -1.780838 -0.000322
H -4.994008 -1.887619 -0.896105
H -4.994302 -1.887091 0.896062
H -4.569534 2.723147 -0.001204
H -2.242439 3.639486 -0.001265
H 1.743570 4.049068 -0.001111
H 4.032742 -2.712229 0.000870
H -0.642666 -4.554013 0.001052
H 5.673446 0.917670 0.000001
H 4.093951 4.985168 -0.001199
H 3.670234 -5.216109 0.001522
H 1.330092 -6.135501 0.001613
H 6.059344 3.416459 -0.000642


