%chk=000254821.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254821

0 1
O 0.287458 -0.188688 1.443855
O -1.424987 -2.415914 1.080041
N -3.232043 -2.980362 -0.182354
C 0.798087 0.023028 0.121945
C -0.279711 -0.384064 -0.923449
C 1.118466 1.512246 0.044602
C 2.071950 -0.809801 -0.032648
C -1.636509 0.166894 -0.591948
C -2.632724 -0.627532 0.004497
C 1.815647 2.032722 -1.054959
C 2.802842 -1.124090 1.122920
C 0.703984 2.370351 1.072750
C 2.535017 -1.244324 -1.280978
C -1.930639 1.509216 -0.895561
C -3.887228 -0.076776 0.313445
C 2.088543 3.401514 -1.126010
C 3.979698 -1.870266 1.031196
C 0.980802 3.738067 0.999114
C 3.714709 -1.990672 -1.370627
C -3.179816 2.047850 -0.595044
C -2.356375 -2.051757 0.366295
C -4.163139 1.255430 0.012856
C 1.671006 4.256459 -0.100871
C 4.438077 -2.305479 -0.216763
C -3.091617 -4.421798 0.104312
H -0.302134 -1.493776 -0.988538
H 0.033234 -0.039363 -1.930413
H -0.182814 -1.076510 1.510519
H 2.160431 1.374033 -1.849873
H 2.436236 -0.779859 2.094423
H 0.165693 1.955679 1.930962
H 1.986752 -1.008548 -2.190312
H -1.160747 2.137849 -1.347229
H -4.643442 -0.689897 0.804347
H 2.632982 3.801084 -1.979127
H 4.540018 -2.111892 1.932575
H 0.659555 4.398705 1.802133
H 4.069241 -2.326691 -2.342841
H -3.391472 3.091879 -0.827038
H -5.134000 1.682272 0.256043
H 1.887103 5.321059 -0.157188
H 5.354953 -2.886542 -0.288660
H -3.991953 -2.706640 -0.793094
H -2.223141 -4.600906 0.772514
H -2.924676 -4.991030 -0.824728
H -3.990714 -4.810265 0.610109


%chk=000254821-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000254821

0 1
O 0.308312 -0.391900 1.453929
O -1.348347 -2.437661 0.973409
N -3.404882 -2.953236 0.044140
C 0.850449 -0.052764 0.143779
C -0.212738 -0.398162 -0.977070
C 1.139979 1.465998 0.154677
C 2.164521 -0.841390 -0.093645
C -1.606070 0.143962 -0.701212
C -2.639578 -0.638086 -0.098754
C 1.875457 2.071822 -0.896007
C 2.992721 -1.102727 1.028360
C 0.649089 2.278272 1.203912
C 2.594317 -1.285784 -1.369695
C -1.921022 1.471729 -1.088835
C -3.927444 -0.074343 0.117230
C 2.100057 3.466153 -0.907035
C 4.218210 -1.785304 0.879434
C 0.880083 3.673383 1.198222
C 3.820707 -1.974419 -1.521060
C -3.199244 2.027783 -0.872642
C -2.400322 -2.057284 0.345768
C -4.210432 1.253755 -0.259831
C 1.601181 4.275115 0.141681
C 4.639931 -2.224634 -0.398280
C -3.363431 -4.362231 0.456021
H -0.234309 -1.497854 -1.076518
H 0.144816 0.019853 -1.935036
H -0.230342 -1.248240 1.376196
H 2.296384 1.453869 -1.698032
H 2.646485 -0.773848 2.013026
H 0.096463 1.794075 2.013178
H 1.977146 -1.112324 -2.258465
H -1.140311 2.077617 -1.561234
H -4.698029 -0.665518 0.626618
H 2.673571 3.918726 -1.724449
H 4.844157 -1.977475 1.758652
H 0.496200 4.289402 2.019947
H 4.133329 -2.314937 -2.515229
H -3.402065 3.061015 -1.174648
H -5.201180 1.680645 -0.070724
H 1.780642 5.356520 0.138045
H 5.590643 -2.757315 -0.515363
H -4.181221 -2.625965 -0.532931
H -2.439707 -4.513634 1.035783
H -3.347802 -5.032978 -0.422159
H -4.233771 -4.616786 1.088047


