%chk=000237437.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237437

0 1
O -3.012211 -1.709515 -1.454519
O -3.989174 2.445206 0.315907
N -0.405351 -1.617845 0.222286
N -2.005798 1.492885 0.990643
N 0.073814 0.199483 1.531076
N -3.506326 0.359868 -0.566798
C -1.473334 -0.712139 0.077248
C 0.509756 -1.035969 1.095892
C -1.145918 0.400228 0.902062
C 1.789811 -1.658077 1.532834
C 2.754319 -1.948946 0.372143
C -2.672653 -0.802124 -0.717537
C -3.226992 1.499194 0.249128
C -0.337990 -2.923026 -0.437298
C 3.321133 -0.685144 -0.219588
C -1.659310 2.647848 1.853851
C -4.789386 0.413227 -1.321029
C 2.618009 0.004991 -1.218444
C 4.557360 -0.193740 0.225469
C 3.151022 1.173860 -1.768116
C 5.085944 0.975408 -0.328829
C 4.385875 1.660284 -1.326832
H 2.286353 -0.971049 2.263210
H 1.579120 -2.591774 2.097585
H 2.244123 -2.546734 -0.415894
H 3.573911 -2.600615 0.742231
H 0.655784 -3.074548 -0.904607
H -0.523208 -3.740331 0.283544
H -1.117271 -2.997955 -1.231105
H -2.407080 3.454236 1.730123
H -0.660425 3.037060 1.585091
H -1.637041 2.339067 2.914050
H -4.899020 -0.495411 -1.942687
H -4.813497 1.301228 -1.976194
H -5.642481 0.475062 -0.623542
H 1.651236 -0.359985 -1.559696
H 5.106321 -0.717286 1.004884
H 2.600254 1.708818 -2.540548
H 6.045315 1.354303 0.019885
H 4.798603 2.570562 -1.756477


%chk=000237437-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000237437

0 1
O -3.205515 -1.807879 -1.337152
O -3.822916 2.588156 0.258848
N -0.481388 -1.732823 0.205676
N -1.846594 1.487486 0.886378
N 0.139207 0.107394 1.411732
N -3.481868 0.403998 -0.523559
C -1.500264 -0.776488 0.047734
C 0.485829 -1.158053 1.029809
C -1.082532 0.333203 0.799388
C 1.751872 -1.844766 1.446523
C 2.821916 -1.993668 0.311001
C -2.750432 -0.828272 -0.662000
C -3.088704 1.559726 0.214466
C -0.479565 -3.080362 -0.389989
C 3.320851 -0.660412 -0.226102
C -1.371157 2.640303 1.675562
C -4.792319 0.507556 -1.205827
C 2.732541 -0.067115 -1.371759
C 4.373225 0.030031 0.428194
C 3.180109 1.185024 -1.850659
C 4.824833 1.281601 -0.046231
C 4.228350 1.864278 -1.188638
H 2.178561 -1.247769 2.269974
H 1.524638 -2.852821 1.848300
H 2.403255 -2.602586 -0.511879
H 3.665737 -2.570117 0.735611
H 0.209825 -3.132431 -1.251186
H -0.174192 -3.826909 0.362442
H -1.497675 -3.300333 -0.745938
H -2.099614 3.454015 1.548032
H -0.375960 2.952891 1.318753
H -1.292114 2.365545 2.741062
H -4.967760 -0.446742 -1.723382
H -4.779069 1.342862 -1.924860
H -5.588412 0.700722 -0.468376
H 1.921246 -0.588093 -1.896625
H 4.845509 -0.417318 1.312426
H 2.714297 1.627641 -2.738422
H 5.641370 1.799197 0.469975
H 4.578471 2.833935 -1.559902


