%chk=000267125.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267125

0 1
O -2.057367 2.071551 0.790769
O -3.532029 -1.768844 -0.325117
O -0.073634 2.626367 -0.196531
O -2.984169 -0.013872 -1.690171
N 2.097343 -1.603501 1.111829
N -0.722185 0.374556 -0.107158
N -1.813873 -0.430104 0.335500
C 0.569765 -0.180987 0.186122
C 0.741694 -1.251497 1.084314
C 1.850454 0.164860 -0.354730
C 2.796128 -0.744846 0.240440
C -0.391871 -1.837638 1.759001
C 2.303755 1.146282 -1.259535
C 4.170658 -0.683587 -0.077340
C 2.675486 -2.687694 1.910339
C -1.614913 -1.438945 1.348118
C 3.650307 1.193035 -1.563991
C 4.573339 0.283445 -0.978641
C -0.865004 1.793494 0.178091
C -2.771964 -0.678067 -0.709711
C -2.429449 3.487735 0.899162
C -4.675702 -2.102372 -1.182239
C -1.613993 4.160249 1.981750
C -4.194564 -2.760248 -2.456296
H -0.243243 -2.551643 2.561850
H 1.582692 1.852738 -1.680266
H 4.877058 -1.370399 0.374718
H 2.845963 -2.359841 2.953014
H 2.006936 -3.567188 1.924822
H 3.644593 -3.010383 1.488871
H -2.563085 -1.826078 1.743015
H 4.026646 1.939602 -2.260745
H 5.624704 0.364354 -1.253395
H -2.301839 3.959304 -0.091185
H -3.500950 3.385328 1.153325
H -5.226598 -2.788663 -0.512641
H -5.254332 -1.180093 -1.367638
H -0.552897 4.230403 1.691876
H -1.652846 3.600389 2.924857
H -1.968989 5.178132 2.179164
H -3.509246 -3.592692 -2.250576
H -3.648052 -2.044337 -3.092032
H -5.030124 -3.151405 -3.048510


%chk=000267125-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000267125

0 1
O -2.182376 2.044772 0.614874
O -3.562084 -1.573793 -0.243223
O 0.046755 2.683126 0.205407
O -2.680408 0.097343 -1.654299
N 2.229389 -1.641763 1.083962
N -0.590412 0.432832 0.178030
N -1.636650 -0.515423 0.375366
C 0.718295 -0.140180 0.261256
C 0.889194 -1.226196 1.139012
C 1.978037 0.158036 -0.359947
C 2.910823 -0.806311 0.182623
C -0.227081 -1.780898 1.875676
C 2.441632 1.125117 -1.290695
C 4.269496 -0.830237 -0.202586
C 2.825929 -2.775325 1.789843
C -1.489788 -1.421421 1.467043
C 3.793509 1.095790 -1.676532
C 4.698263 0.129390 -1.141545
C -0.840237 1.805705 0.344042
C -2.625172 -0.604164 -0.621993
C -2.568614 3.485822 0.680761
C -4.679994 -1.785293 -1.211401
C -2.308117 4.059193 2.075982
C -4.266486 -2.757002 -2.319350
H -0.103268 -2.459562 2.722493
H 1.756666 1.884491 -1.676140
H 4.971513 -1.560536 0.213860
H 3.551764 -2.436386 2.552634
H 2.036934 -3.356829 2.291260
H 3.346005 -3.444507 1.080201
H -2.414902 -1.815458 1.887748
H 4.165849 1.833921 -2.395260
H 5.746493 0.139590 -1.460621
H -2.002623 4.034765 -0.092131
H -3.640750 3.472283 0.427790
H -5.488110 -2.190974 -0.581649
H -4.974854 -0.804990 -1.624993
H -1.227579 4.068794 2.295412
H -2.827852 3.466476 2.848656
H -2.682124 5.098934 2.127526
H -3.915292 -3.713091 -1.894167
H -3.464097 -2.322559 -2.938483
H -5.133072 -2.966580 -2.973943


