%chk=000243810.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000243810

0 1
O -0.522795 -2.138099 -0.355562
O -1.432938 -1.287360 1.539853
O 1.831376 -0.728465 1.462966
N -0.462009 2.152635 1.628602
C -0.379136 0.212992 -0.135969
C -1.323403 0.550222 -1.322264
C 1.067162 0.079929 -0.661646
C -2.771334 0.663789 -0.924989
C -0.849706 -1.112283 0.505772
C 2.111186 -0.213407 0.405816
C -0.432723 1.287743 0.865851
C -3.280883 1.876855 -0.439427
C -3.621599 -0.443903 -1.060184
C 3.511782 0.182265 0.062252
C -4.630106 1.977133 -0.088943
C -4.970084 -0.337197 -0.710181
C -0.818422 -3.506389 0.080020
C 4.033735 0.019252 -1.228518
C 4.317326 0.708038 1.083602
C -5.476888 0.872501 -0.224700
C 5.352853 0.392423 -1.497070
C 5.633590 1.088922 0.808073
C -2.289716 -3.807183 -0.106940
C 6.150953 0.931683 -0.481223
H -1.203667 -0.233998 -2.102622
H -0.988935 1.495583 -1.799856
H 1.343477 1.000471 -1.217519
H 1.101185 -0.751838 -1.405444
H -2.628000 2.740904 -0.322274
H -3.230502 -1.390217 -1.430900
H -5.020108 2.918602 0.296182
H -5.626685 -1.199646 -0.812340
H -0.492121 -3.612678 1.131257
H -0.162006 -4.082763 -0.596456
H 3.423174 -0.407733 -2.022624
H 3.910330 0.812042 2.093143
H -6.526483 0.952835 0.051559
H 5.761651 0.262376 -2.498017
H 6.255935 1.503115 1.600753
H -2.614524 -3.640807 -1.140600
H -2.908803 -3.166229 0.541890
H -2.520050 -4.847837 0.152842
H 7.178308 1.226017 -0.695565


%chk=000243810-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000243810

0 1
O -0.345722 -1.970362 -0.131202
O -1.480472 -0.993351 1.663237
O 1.721070 -0.353410 1.529854
N -0.696623 2.526144 1.527295
C -0.443887 0.429644 -0.105901
C -1.425878 0.625948 -1.341068
C 1.011020 0.406172 -0.664812
C -2.909794 0.662028 -1.011513
C -0.808205 -0.887820 0.623188
C 2.071620 0.066595 0.388831
C -0.591779 1.563453 0.832976
C -3.528860 1.854925 -0.556728
C -3.707317 -0.499205 -1.174599
C 3.518072 0.216981 0.027734
C -4.909478 1.881473 -0.262321
C -5.089491 -0.474898 -0.884776
C -0.586579 -3.326965 0.456255
C 3.947354 0.596021 -1.273659
C 4.491710 -0.039208 1.032226
C -5.694927 0.716928 -0.425282
C 5.323090 0.714922 -1.562889
C 5.864149 0.084194 0.743479
C -1.964825 -3.864343 0.063650
C 6.283616 0.461559 -0.555829
H -1.210706 -0.204188 -2.038285
H -1.122399 1.568567 -1.835388
H 1.234197 1.385305 -1.128490
H 1.066149 -0.357908 -1.464272
H -2.929189 2.762951 -0.424618
H -3.243380 -1.425093 -1.537002
H -5.371099 2.809066 0.093677
H -5.691904 -1.380503 -1.018473
H -0.482175 -3.246558 1.552096
H 0.232401 -3.935536 0.040355
H 3.217420 0.794348 -2.065723
H 4.141277 -0.328946 2.028360
H -6.766694 0.738998 -0.198385
H 5.647526 1.005481 -2.567883
H 6.607480 -0.109899 1.524063
H -2.081422 -3.894791 -1.034214
H -2.765140 -3.242249 0.497282
H -2.081294 -4.894640 0.448508
H 7.351487 0.558465 -0.781153


