%chk=000210480.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210480

0 1
O -6.214169 -1.717152 -0.619613
O 4.080277 -1.369317 1.827825
O 8.253090 2.512947 -0.820852
N -2.657624 -1.418394 -0.192946
N 0.228021 -1.359426 0.123613
C -1.804097 -2.568229 -0.638485
C -1.887387 -0.137787 -0.318448
C -0.543438 -2.640427 0.247255
C -0.629870 -0.212207 0.569668
C -3.939481 -1.357281 -0.960337
C 1.500919 -1.423077 0.911893
C -5.077142 -1.122483 0.062790
C 2.523580 -0.478892 0.256626
C -5.324702 0.345420 0.331884
C 3.884578 -0.602883 0.903419
C -4.751346 0.952380 1.457956
C -6.112915 1.105204 -0.543630
C 4.981618 0.254197 0.376769
C -7.362445 -1.929790 0.221688
C -4.965731 2.311697 1.703422
C -6.327629 2.462653 -0.293501
C -5.753735 3.067903 0.829695
C 4.843965 1.073981 -0.750322
C 6.219269 0.218541 1.059456
C 5.906838 1.857767 -1.204202
C 7.290745 0.986815 0.633253
C 7.121813 1.806549 -0.505153
C 8.214066 3.390804 -1.973881
H -2.389501 -3.504712 -0.516756
H -1.504979 -2.494964 -1.706833
H -1.591381 0.085555 -1.366714
H -2.537581 0.695367 0.027844
H -0.836611 -2.867484 1.295647
H 0.102685 -3.472177 -0.106703
H -0.046184 0.725562 0.458397
H -0.930903 -0.290020 1.637598
H -4.154247 -2.314090 -1.489418
H -3.957380 -0.573956 -1.745414
H 1.907413 -2.459835 0.896211
H 1.377251 -1.164371 1.985623
H -4.889015 -1.685879 1.005013
H 2.168650 0.569553 0.310258
H 2.586944 -0.712817 -0.828656
H -4.134011 0.365223 2.137668
H -6.559931 0.620100 -1.413136
H -7.122991 -2.636298 1.021612
H -7.723823 -0.979893 0.627927
H -8.093260 -2.360437 -0.472916
H -4.520030 2.781330 2.578202
H -6.941967 3.049525 -0.973670
H -5.921183 4.125144 1.023845
H 3.898761 1.110205 -1.295789
H 6.316621 -0.432525 1.936576
H 5.782128 2.485464 -2.079335
H 8.249483 0.972776 1.147305
H 8.025775 2.814032 -2.883846
H 7.471137 4.179501 -1.825508
H 9.231966 3.803707 -1.973374


%chk=000210480-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210480

0 1
O -6.439179 -1.578203 -0.732740
O 4.031565 -1.417416 1.821371
O 8.119380 2.778562 -0.802590
N -2.732915 -1.632408 -0.291112
N 0.141265 -1.553393 0.111863
C -1.922403 -2.871421 -0.329223
C -1.931151 -0.469268 -0.736281
C -0.675613 -2.711932 0.557033
C -0.678013 -0.314433 0.140717
C -4.061825 -1.737775 -0.932179
C 1.393956 -1.442986 0.900865
C -5.202512 -1.247240 0.000495
C 2.412705 -0.494263 0.246526
C -5.115627 0.236732 0.341841
C 3.800887 -0.584565 0.890918
C -4.547352 0.662858 1.567006
C -5.569425 1.211397 -0.583877
C 4.884024 0.323919 0.398556
C -7.646250 -1.446745 0.086280
C -4.422075 2.040419 1.860543
C -5.451469 2.587775 -0.290240
C -4.873726 3.007247 0.932373
C 4.695889 1.247330 -0.662348
C 6.166182 0.257354 1.019853
C 5.743001 2.084922 -1.098614
C 7.216318 1.082200 0.600757
C 7.008970 2.002591 -0.462625
C 7.972316 3.749644 -1.892423
H -2.533030 -3.712188 0.048876
H -1.591155 -3.121554 -1.368590
H -1.611411 -0.582296 -1.803360
H -2.546256 0.443573 -0.657369
H -1.008163 -2.594158 1.620119
H -0.056054 -3.625782 0.490348
H -0.076401 0.529672 -0.242760
H -0.998601 -0.064643 1.184886
H -4.283643 -2.793849 -1.174384
H -4.114289 -1.169347 -1.886335
H 1.849209 -2.447055 0.968656
H 1.200778 -1.116366 1.953230
H -5.150236 -1.843434 0.938820
H 2.069647 0.558267 0.290673
H 2.490404 -0.748952 -0.830362
H -4.191257 -0.087217 2.282888
H -6.025728 0.876119 -1.522760
H -7.594619 -2.101061 0.982283
H -7.807925 -0.400634 0.415341
H -8.484143 -1.766251 -0.553753
H -3.977881 2.358566 2.810766
H -5.809509 3.333114 -1.009986
H -4.782344 4.075278 1.160927
H 3.725104 1.318616 -1.164015
H 6.303660 -0.460035 1.835466
H 5.567975 2.785546 -1.920186
H 8.203476 1.040544 1.070583
H 7.719937 3.246680 -2.845599
H 7.201031 4.506499 -1.652630
H 8.955401 4.234545 -1.977019


