%chk=000268278.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268278

0 1
O 0.951442 -1.096113 -0.635312
O -1.811936 1.011232 1.596742
N -1.684337 -0.497403 -0.146552
C 0.265187 0.943584 0.413410
C 0.280958 1.936165 -0.768478
C -0.381989 3.273448 -0.415707
C 2.577733 -0.083591 0.809846
C 1.243506 -0.191921 0.118411
C 3.582363 -1.119680 0.291449
C 4.914608 -1.035714 1.044241
C 0.471787 4.153618 0.507152
C -1.172893 0.493865 0.698947
C 5.917516 -2.071671 0.516254
C 1.684295 4.757949 -0.196439
C 7.248466 -1.997832 1.260449
C -3.006018 -1.047988 -0.091774
C -3.298095 -2.101406 -0.985157
C -3.990073 -0.571419 0.790604
C -4.574775 -2.661948 -0.986255
C -5.260962 -1.148755 0.771518
C -5.560222 -2.190193 -0.111907
H 0.591248 1.500361 1.336655
H 1.327798 2.114666 -1.088623
H -0.229417 1.483797 -1.642838
H -1.365662 3.089644 0.067973
H -0.609326 3.822657 -1.350769
H 2.430004 -0.213321 1.904872
H 2.989419 0.941027 0.693193
H 3.742901 -0.973004 -0.795380
H 3.147985 -2.136748 0.385250
H 4.751089 -1.194407 2.127800
H 5.343550 -0.019574 0.950531
H 0.798386 3.567535 1.389365
H -0.162508 4.967674 0.914154
H 5.492099 -3.090404 0.611524
H 6.085937 -1.915792 -0.567568
H 2.268631 5.382900 0.488542
H 2.353685 3.985642 -0.590339
H 1.385312 5.391002 -1.040203
H -1.041041 -0.934879 -0.833058
H 7.718141 -1.013373 1.154690
H 7.124063 -2.188401 2.332604
H 7.957179 -2.741009 0.877076
H -2.539370 -2.479383 -1.666359
H -3.763715 0.240714 1.488990
H -4.804038 -3.475099 -1.674371
H -6.025157 -0.780034 1.455840
H -6.552854 -2.632719 -0.119094


%chk=000268278-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268278

0 1
O 0.925234 -1.146892 -0.651083
O -1.761635 1.322023 1.569398
N -1.661920 -0.407033 -0.031102
C 0.333002 1.002717 0.352978
C 0.371494 1.925576 -0.922842
C -0.429390 3.243194 -0.779120
C 2.652685 -0.109558 0.728436
C 1.272692 -0.177731 0.091546
C 3.647386 -1.177559 0.239265
C 5.007581 -1.094313 0.966275
C 0.015598 4.165534 0.382939
C -1.131402 0.638941 0.703445
C 6.021884 -2.148695 0.466967
C 1.500359 4.589436 0.324219
C 7.378022 -2.073872 1.200417
C -2.981292 -0.938978 0.006717
C -3.249554 -2.062980 -0.822244
C -4.017019 -0.399125 0.816825
C -4.535142 -2.639185 -0.844456
C -5.299657 -0.988494 0.781873
C -5.571006 -2.104834 -0.042001
H 0.708993 1.584363 1.212182
H 1.430996 2.161425 -1.146923
H -0.014247 1.346287 -1.783648
H -1.504157 3.009843 -0.656386
H -0.329155 3.793510 -1.737444
H 2.503540 -0.190687 1.828226
H 3.056382 0.914389 0.576105
H 3.796770 -1.064627 -0.852499
H 3.202281 -2.180595 0.380998
H 4.854594 -1.226184 2.058237
H 5.442189 -0.080934 0.833595
H -0.204771 3.670642 1.347801
H -0.618181 5.073899 0.359040
H 5.586014 -3.160509 0.593940
H 6.179977 -2.013683 -0.622409
H 1.737032 5.310263 1.128068
H 2.183398 3.726804 0.445876
H 1.740218 5.071359 -0.642941
H -0.969964 -0.902709 -0.620999
H 7.848775 -1.081507 1.066168
H 7.251615 -2.240073 2.286993
H 8.084315 -2.835795 0.822962
H -2.448757 -2.482169 -1.444387
H -3.803420 0.458051 1.457761
H -4.727242 -3.505385 -1.487365
H -6.093758 -0.567930 1.409348
H -6.570453 -2.552520 -0.058851


