%chk=000289574.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289574

0 1
O 3.537629 1.240990 1.501177
O -0.466934 -3.141379 -0.004509
O -3.787419 -0.596078 1.542782
N -3.976736 0.638143 0.939369
C 2.267244 0.007691 -0.123059
C 0.854135 0.128548 -0.678236
C 2.347752 -1.120499 0.931923
C 0.502743 1.460067 -1.282900
C 2.770033 1.300556 0.568405
C 0.000630 -0.915486 -0.685757
C 0.837153 2.619241 -0.339086
C 2.322502 2.629964 0.009239
C 1.755640 -2.427123 0.423328
C 3.232426 -0.254271 -1.292515
C 0.342975 -2.239157 -0.080910
C -1.389145 -0.866475 -1.274332
C -2.401231 -0.522397 -0.244506
C -3.168674 0.716108 -0.128754
C -2.826218 -1.292827 0.809025
C -3.105723 1.883579 -1.033272
H 1.819959 -0.799443 1.854815
H 3.403384 -1.265929 1.243092
H 1.044432 1.574514 -2.245750
H -0.583400 1.514274 -1.543619
H 0.550818 3.582871 -0.804089
H 0.229738 2.538612 0.587052
H 2.546827 3.434320 0.743141
H 2.938572 2.872309 -0.881504
H 1.767193 -3.198528 1.223205
H 2.373059 -2.857784 -0.392982
H 4.263247 -0.383800 -0.936732
H 2.960214 -1.170960 -1.830626
H 3.229782 0.564091 -2.020509
H -1.637435 -1.868084 -1.707733
H -1.438127 -0.161041 -2.129464
H -2.592106 -2.272241 1.175790
H -3.693953 1.703886 -1.947451
H -3.515327 2.792305 -0.562275
H -2.064159 2.099333 -1.334674


%chk=000289574-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289574

0 1
O 3.364457 1.302869 1.680496
O -0.542656 -3.156503 -0.017885
O -3.932947 -0.784322 1.564064
N -4.126289 0.574934 1.039288
C 2.296096 0.004354 -0.101578
C 0.901359 0.123000 -0.750836
C 2.354362 -1.136730 0.948237
C 0.638843 1.431032 -1.480405
C 2.720630 1.335376 0.601127
C -0.024868 -0.902097 -0.687400
C 0.917326 2.666546 -0.586825
C 2.377446 2.655246 -0.080755
C 1.743688 -2.440012 0.412495
C 3.374695 -0.232711 -1.223066
C 0.319404 -2.223626 -0.077581
C -1.448188 -0.838248 -1.255966
C -2.499834 -0.555487 -0.198465
C -3.258930 0.665157 0.000982
C -2.959556 -1.410601 0.788916
C -3.204326 1.947382 -0.784978
H 1.803588 -0.816917 1.852245
H 3.400254 -1.291387 1.263752
H 1.305095 1.490211 -2.367628
H -0.391163 1.476042 -1.864191
H 0.729419 3.591795 -1.161962
H 0.223234 2.669670 0.275723
H 2.581461 3.473778 0.629934
H 3.061082 2.790460 -0.944976
H 1.730604 -3.230253 1.182849
H 2.338907 -2.839233 -0.434433
H 4.384046 -0.258129 -0.774999
H 3.191787 -1.197553 -1.727045
H 3.357047 0.557309 -1.993489
H -1.665118 -1.822398 -1.708282
H -1.525678 -0.087873 -2.059464
H -2.705203 -2.434209 1.051814
H -3.354485 1.761427 -1.864271
H -3.993731 2.634034 -0.438919
H -2.230356 2.455567 -0.659428


