%chk=000268949.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268949

0 1
O -1.850694 -0.871329 0.117865
O -0.526321 1.654993 0.686146
O 2.315734 -1.699583 0.336888
O 2.747101 1.314674 -0.332712
O -0.467068 -1.809505 1.638313
O 0.173985 1.842707 -1.460260
O 4.492170 -1.186242 -0.153736
O 2.455731 3.234668 0.856354
N -4.856844 0.320975 -0.025864
C -3.615070 0.657593 0.776004
C -2.906583 -0.681958 1.114689
C -3.940347 -1.791553 0.878210
C -5.137216 -1.137678 0.157641
C -2.830992 1.607372 -0.112421
C -4.565455 0.737367 -1.450326
C 1.633913 -0.770984 -0.549839
C -3.348575 1.626468 -1.352280
C 0.232911 -1.434138 -0.725088
C 1.570508 0.631673 0.181732
C -1.723004 2.451393 0.406781
C -0.650324 -1.416198 0.512805
C 2.318135 -0.643066 -1.899918
C 0.354340 1.441559 -0.336224
C 0.356666 -2.897475 -1.157572
C 1.647929 0.552161 1.690268
C 3.682906 -1.812550 0.480544
C 3.120792 2.580848 0.094871
C 3.914218 -2.841786 1.535375
C 4.410421 2.900333 -0.573093
H -3.947864 1.151915 1.719988
H -2.447993 -0.695213 2.122993
H -4.249555 -2.254536 1.830798
H -3.498276 -2.601830 0.270156
H -5.364869 -1.645982 -0.797983
H -6.055657 -1.200212 0.782121
H -5.454731 1.295075 -1.814629
H -4.390817 -0.110646 -2.141961
H -3.002240 2.186769 -2.205671
H -0.300635 -0.859911 -1.539624
H -1.447891 3.267859 -0.290450
H -1.933325 2.863826 1.414288
H 3.353808 -0.264889 -1.785805
H 2.386034 -1.599277 -2.428196
H 1.799508 0.081682 -2.545681
H 0.891842 -3.487377 -0.397103
H -0.627075 -3.355765 -1.315076
H 0.916985 -2.989737 -2.096775
H 0.945327 -0.184964 2.112361
H 2.651526 0.257601 2.021541
H 1.416623 1.525421 2.156862
H 4.416710 -3.726217 1.115277
H 2.973399 -3.180585 2.004404
H 4.561099 -2.443431 2.332146
H 4.244097 3.525037 -1.465831
H 4.942986 1.991302 -0.907518
H 5.076119 3.457046 0.104317


%chk=000268949-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268949

0 1
O -1.936633 -0.955076 0.107936
O -0.508846 1.556081 0.828401
O 2.390834 -1.870419 0.370504
O 2.820890 1.303502 -0.304125
O -0.466595 -1.802743 1.710313
O 0.191781 1.735124 -1.388166
O 4.600549 -1.071526 0.142669
O 2.036347 3.346314 0.515395
N -4.787211 0.267438 -0.170057
C -3.666898 0.663341 0.756071
C -2.967250 -0.667888 1.150022
C -4.108667 -1.696292 1.032141
C -4.894771 -1.218144 -0.214793
C -2.859997 1.682510 -0.039122
C -4.631097 0.983324 -1.469418
C 1.676697 -0.869661 -0.491759
C -3.407060 1.856478 -1.269842
C 0.246532 -1.516166 -0.670597
C 1.638599 0.551936 0.251178
C -1.695852 2.442329 0.521840
C -0.694977 -1.438393 0.535776
C 2.334513 -0.752882 -1.884271
C 0.377435 1.349043 -0.211845
C 0.309727 -3.017832 -1.070630
C 1.806906 0.475167 1.776348
C 3.776752 -1.898855 0.584681
C 2.912090 2.679777 -0.083576
C 4.103373 -3.102063 1.448592
C 4.186857 3.214212 -0.693845
H -4.058825 1.115256 1.694673
H -2.470732 -0.651308 2.134134
H -4.740582 -1.631502 1.937370
H -3.736020 -2.729470 0.942457
H -4.424541 -1.627214 -1.138803
H -5.947805 -1.553575 -0.190006
H -5.528224 1.586164 -1.721946
H -4.478409 0.267588 -2.311151
H -3.023970 2.533452 -2.038975
H -0.241166 -0.952099 -1.484629
H -1.354317 3.229449 -0.170295
H -1.916202 2.871417 1.514361
H 3.377809 -0.426991 -1.793203
H 2.301887 -1.723313 -2.406094
H 1.783494 -0.002892 -2.477230
H 0.752619 -3.612159 -0.256657
H -0.710963 -3.389318 -1.272082
H 0.906899 -3.165787 -1.984871
H 1.114533 -0.254139 2.219307
H 2.839801 0.166607 2.005581
H 1.623424 1.466274 2.217004
H 3.830493 -4.032485 0.920307
H 3.513917 -3.072035 2.380869
H 5.178359 -3.109931 1.679627
H 4.058152 3.303728 -1.788012
H 5.023039 2.520389 -0.511765
H 4.407405 4.208959 -0.279691


