%chk=000212790.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212790

0 1
N 0.297542 -0.545040 -0.066127
N 3.185809 -0.512710 -0.013454
N 5.053367 -1.366545 1.253958
N 5.347561 1.513422 -1.148078
N 7.332544 -0.502395 1.061468
N 7.555372 1.419389 -0.531130
C 1.071045 0.639704 -0.561736
C 1.089198 -1.797356 -0.302032
C -1.048904 -0.630218 -0.721228
C 2.391914 0.738219 0.227176
C 2.425489 -1.718337 0.460229
C -1.999853 0.356731 -0.022765
C -3.419697 0.290640 -0.621837
C 4.549002 -0.451307 0.386134
C -4.061581 -1.059743 -0.361980
C -4.320679 1.398552 -0.107932
C 5.449671 0.484725 -0.202018
C -4.298740 -1.930287 -1.436796
C -5.330232 1.889004 -0.953590
C -4.413350 -1.456150 0.936940
C -4.185501 1.935628 1.179923
C 6.853992 0.428273 0.171351
C -4.878448 -3.182298 -1.212342
C -6.183813 2.904578 -0.517690
C -4.992101 -2.708500 1.156637
C -5.041128 2.953883 1.611963
C 6.409589 -1.357563 1.538984
C -5.225049 -3.575139 0.083691
C -6.040386 3.442028 0.765891
C 6.643532 2.038486 -1.310899
H 0.466055 1.554445 -0.375577
H 1.280883 0.597369 -1.652550
H 1.279463 -1.994548 -1.379438
H 0.504125 -2.657040 0.094103
H -1.016917 -0.437910 -1.814110
H -1.445864 -1.663956 -0.595122
H 2.962898 1.629274 -0.096607
H 2.170081 0.869174 1.313007
H 2.247447 -1.688229 1.558999
H 3.032446 -2.629360 0.256631
H -1.612965 1.390943 -0.105828
H -2.020078 0.130876 1.063241
H -3.315034 0.431558 -1.732545
H -4.036798 -1.634213 -2.450043
H -5.456196 1.471452 -1.950861
H -4.242092 -0.783401 1.775972
H -3.415930 1.563702 1.854208
H 4.513921 1.744498 -1.655589
H -5.061752 -3.852158 -2.050750
H -6.964521 3.277447 -1.178834
H -5.264163 -3.009369 2.167253
H -4.927798 3.365616 2.613648
H 6.746378 -2.133894 2.247188
H -5.676459 -4.549472 0.257171
H -6.705286 4.233660 1.104008
H 6.862486 2.855964 -1.989186


%chk=000212790-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212790

0 1
N 0.336721 -0.540106 0.193373
N 3.208538 -0.472494 0.456298
N 5.203985 -1.713366 0.631778
N 5.255232 1.790997 -0.775714
N 7.446059 -0.910904 0.050663
N 7.501824 1.380696 -0.875474
C 1.113236 0.630372 -0.274168
C 1.147955 -1.780184 0.071626
C -0.996892 -0.653244 -0.450076
C 2.411118 0.763344 0.547981
C 2.446733 -1.666190 0.890197
C -2.007170 0.366253 0.114485
C -3.389751 0.304732 -0.596727
C 4.586252 -0.534752 0.289607
C -4.057504 -1.066958 -0.397375
C -4.330205 1.451527 -0.187855
C 5.426480 0.502014 -0.235500
C -4.094470 -2.012830 -1.452332
C -5.442996 1.756663 -1.015974
C -4.625112 -1.424608 0.853329
C -4.149665 2.209918 0.996433
C 6.843341 0.263020 -0.321475
C -4.679618 -3.287014 -1.266687
C -6.345546 2.786580 -0.676355
C -5.207318 -2.696486 1.044329
C -5.053130 3.241788 1.343205
C 6.560041 -1.838980 0.492314
C -5.236529 -3.634397 -0.015244
C -6.154415 3.535422 0.509417
C 6.523345 2.257778 -1.134167
H 0.511615 1.546974 -0.140487
H 1.375376 0.544249 -1.361540
H 1.410093 -2.001171 -0.994161
H 0.553660 -2.627481 0.459230
H -0.926931 -0.539062 -1.563946
H -1.375662 -1.674177 -0.260520
H 2.987420 1.637402 0.211244
H 2.136120 0.940659 1.609590
H 2.194995 -1.574132 1.967039
H 3.090726 -2.548161 0.758951
H -1.609392 1.394591 0.010743
H -2.117598 0.167369 1.196905
H -3.198215 0.413816 -1.685313
H -3.664997 -1.749106 -2.427501
H -5.603735 1.173652 -1.931717
H -4.627493 -0.696483 1.673376
H -3.299401 2.005650 1.655481
H 4.382693 2.290975 -0.929698
H -4.701825 -4.003807 -2.095530
H -7.195840 3.005522 -1.332284
H -5.644771 -2.955187 2.015443
H -4.895123 3.815674 2.263687
H 6.973154 -2.809951 0.782479
H -5.692441 -4.619842 0.132073
H -6.853594 4.335571 0.776902
H 6.671123 3.239967 -1.579260


