%chk=000249992.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249992

0 1
O -2.611116 0.018174 0.812241
O -3.519925 -1.749273 -0.353250
N 3.705591 -0.751565 0.687103
N -0.934469 -0.191776 -0.817748
N -4.675965 0.278456 -0.168195
C 2.829963 -0.519481 -0.518732
C 3.324549 0.773819 -1.229397
C 4.576525 1.235956 -0.469828
C 4.523515 0.491128 0.877785
C 1.380580 -0.393172 -0.097108
C 4.554370 -1.967075 0.529593
C 0.975836 -0.373077 1.248478
C 0.390352 -0.304412 -1.096892
C -0.376949 -0.269815 1.570370
C -1.279826 -0.185194 0.495923
C -3.624285 -0.613016 0.032524
C -5.999832 -0.319251 -0.473793
C -4.706022 1.575245 0.546470
H 2.900638 -1.385237 -1.227291
H 2.547220 1.558296 -1.210009
H 3.542616 0.580498 -2.291014
H 5.494615 0.982499 -1.026699
H 4.588622 2.328654 -0.329508
H 5.529789 0.274729 1.277644
H 3.994155 1.100958 1.642111
H 5.134768 -2.116699 1.454621
H 5.254235 -1.938853 -0.318017
H 3.900926 -2.848133 0.417100
H 1.724177 -0.450110 2.044172
H 0.646977 -0.318394 -2.162990
H -0.732564 -0.261274 2.596158
H -5.868771 -1.285810 -0.999562
H -6.550143 0.356562 -1.150535
H -6.606969 -0.495910 0.428140
H -5.329123 2.287659 -0.019491
H -3.681278 1.993070 0.605281
H -5.098980 1.490125 1.572245


%chk=000249992-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249992

0 1
O -2.607401 0.464565 0.665968
O -3.152738 -1.793167 0.203201
N 3.756475 -0.679672 0.495475
N -0.876223 0.009393 -0.880742
N -4.778999 -0.097763 0.102208
C 2.942179 0.016901 -0.539913
C 3.640551 1.410964 -0.644222
C 5.117743 1.164518 -0.194033
C 5.166839 -0.338392 0.185805
C 1.470206 0.093147 -0.174430
C 3.494905 -2.123139 0.627857
C 1.055492 0.394190 1.150229
C 0.458830 -0.096558 -1.144596
C -0.317068 0.487929 1.448895
C -1.231025 0.288185 0.389724
C -3.507776 -0.595231 0.281251
C -5.871702 -1.046791 -0.163590
C -5.132917 1.328324 0.155110
H 3.031405 -0.502868 -1.531139
H 3.140071 2.126572 0.030177
H 3.565290 1.811144 -1.669953
H 5.843160 1.398875 -0.992171
H 5.362539 1.795814 0.676793
H 5.550962 -0.941014 -0.677504
H 5.815249 -0.547218 1.055492
H 4.114056 -2.539028 1.442386
H 3.722098 -2.694575 -0.307477
H 2.435105 -2.293378 0.884342
H 1.816837 0.518818 1.927554
H 0.719796 -0.341992 -2.181611
H -0.686343 0.696712 2.455859
H -5.462799 -2.067946 -0.173285
H -6.336593 -0.834384 -1.145349
H -6.649934 -0.971113 0.620117
H -5.641875 1.625703 -0.782139
H -4.225172 1.932198 0.278814
H -5.817421 1.528577 1.002801


