%chk=000294401.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294401

0 1
O -0.139292 0.648531 -0.994731
O -0.786678 -1.270938 -2.078287
O 0.241313 -0.947816 2.152988
O 3.110147 0.223659 0.169179
O 2.001873 -1.110881 -1.285358
N -1.105497 -1.041848 0.251588
C -1.176300 -0.379373 -1.078104
C 0.729491 0.429039 0.136570
C -2.483227 0.267510 -1.515918
C -0.036222 -0.591484 1.034392
C -2.253840 -1.793129 0.808759
C 0.970457 1.790237 0.831714
C -3.244324 0.940292 -0.372481
C -3.284425 -0.860610 1.461988
C -4.091114 -0.036818 0.453105
C 1.986737 -0.252228 -0.429506
C 1.463184 2.814868 -0.190270
C -0.311451 2.255110 1.525792
C 4.398378 -0.386437 -0.194683
C 4.539719 -1.721050 0.501374
H -3.108800 -0.497354 -2.024427
H -2.234177 1.015371 -2.302996
H -1.857263 -2.514286 1.562941
H -2.710903 -2.387329 -0.014021
H 1.769413 1.624704 1.603797
H -3.906330 1.721348 -0.798423
H -2.524487 1.486374 0.284527
H -2.774620 -0.187091 2.181027
H -3.978348 -1.471597 2.074271
H -4.866630 0.535919 1.002030
H -4.649082 -0.714244 -0.223564
H 1.576001 3.806507 0.259820
H 0.760126 2.907271 -1.030312
H 2.437449 2.528337 -0.605477
H -0.235721 3.302149 1.839470
H -1.186320 2.176013 0.855289
H -0.521782 1.662821 2.425243
H 0.190425 -1.511382 -2.020156
H 4.448819 -0.464991 -1.294929
H 5.095129 0.384382 0.183110
H 5.558701 -2.116296 0.411816
H 4.304000 -1.645635 1.572469
H 3.856371 -2.471727 0.075784


%chk=000294401-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294401

0 1
O -0.234513 0.910435 -1.023119
O -0.776344 -1.163934 -2.121268
O 0.325708 -0.679930 2.167080
O 3.099427 0.174720 0.228174
O 1.888260 -0.889310 -1.438776
N -1.070885 -0.823775 0.261061
C -1.182694 -0.246295 -1.104573
C 0.720748 0.688774 0.076071
C -2.578336 0.265005 -1.479105
C -0.012505 -0.343266 1.000689
C -2.014779 -1.833783 0.763017
C 1.048695 2.028498 0.780738
C -3.459616 0.756007 -0.307848
C -3.245824 -1.189077 1.441106
C -4.157963 -0.379037 0.489364
C 1.952704 -0.071976 -0.478872
C 1.697018 3.026358 -0.208109
C -0.208764 2.644280 1.435052
C 4.312580 -0.647820 -0.118549
C 4.272442 -1.985831 0.620914
H -3.090931 -0.546190 -2.027660
H -2.406089 1.080227 -2.205343
H -1.467729 -2.454959 1.494940
H -2.310638 -2.476853 -0.086507
H 1.775197 1.776390 1.576106
H -4.245831 1.409500 -0.732796
H -2.863439 1.390936 0.376585
H -2.884740 -0.539766 2.262189
H -3.839306 -1.997593 1.912820
H -4.976413 0.060801 1.092946
H -4.641401 -1.069944 -0.232836
H 1.935339 3.970841 0.313204
H 1.004859 3.254139 -1.037938
H 2.636033 2.631086 -0.634325
H 0.066830 3.575246 1.962547
H -0.964193 2.896613 0.669720
H -0.661700 1.961406 2.175844
H 0.228529 -1.247568 -2.066955
H 4.337768 -0.781461 -1.213695
H 5.147064 -0.010207 0.212150
H 5.217188 -2.531964 0.442617
H 4.159205 -1.831760 1.707186
H 3.439938 -2.613065 0.261552


