%chk=000297839.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297839

0 1
O 6.930839 0.320842 -1.510095
O 6.756305 0.571534 0.735925
O 2.845813 -1.361470 -1.087696
O -3.918282 0.391417 1.051941
O -0.136279 -0.850040 2.290796
O -3.055610 -0.511042 -0.876420
N 3.967921 0.005222 0.359571
N 1.030402 -2.162775 0.825807
N -2.617310 -1.446652 1.231431
C 4.744998 0.663247 -0.709703
C 4.387141 2.150325 -0.878933
C 4.608920 3.003234 0.376396
C 6.230310 0.521837 -0.349359
C 4.421600 4.487879 0.077008
C 3.043206 -0.990880 0.057285
C 2.327179 -1.609094 1.260177
C -0.149232 -1.636328 1.358883
C -1.440116 -2.206485 0.767540
C 8.375579 0.195815 -1.399826
C -6.076133 0.583010 -0.046099
C -4.786833 1.281523 0.276553
C -3.160742 -0.510295 0.333511
C -6.144602 -0.278781 -1.151244
C -7.211203 0.790270 0.750028
C -7.345703 -0.920157 -1.462144
C -8.411737 0.147591 0.433270
C -8.480669 -0.705693 -0.672528
H 4.548228 0.125363 -1.689481
H 4.978313 2.560131 -1.725078
H 3.325648 2.225024 -1.197050
H 3.904339 2.696010 1.174302
H 5.625231 2.829257 0.787762
H 4.120515 0.347996 1.306359
H 4.562371 5.092359 0.981358
H 3.416376 4.702886 -0.304381
H 5.140121 4.847663 -0.668615
H 2.168255 -0.877569 2.094365
H 2.957882 -2.432435 1.677585
H 1.050661 -2.647170 -0.075320
H -1.413163 -2.227668 -0.352576
H -1.565554 -3.268266 1.098999
H 8.656309 -0.204738 -2.380035
H 8.636675 -0.489986 -0.586767
H 8.800499 1.188523 -1.225165
H -2.594881 -1.185304 2.227379
H -4.900346 2.122161 0.987455
H -4.243153 1.615059 -0.628574
H -5.250670 -0.454115 -1.757958
H -7.160127 1.445842 1.617734
H -7.396630 -1.589184 -2.319697
H -9.292994 0.310153 1.051172
H -9.416370 -1.205145 -0.917348


%chk=000297839-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297839

0 1
O 7.748755 -0.547066 -0.604359
O 6.564582 -0.582752 1.400694
O 2.755275 0.365532 -1.570107
O -5.202525 0.817940 1.153476
O -0.696467 0.255759 1.912031
O -4.544731 0.918622 -1.120335
N 4.266903 0.159155 0.186438
N 0.599953 0.300240 -0.010898
N -3.009821 0.570374 0.611303
C 5.461982 0.188603 -0.672489
C 5.779568 1.608738 -1.236671
C 6.063801 2.674963 -0.157631
C 6.619451 -0.354355 0.167053
C 6.303564 4.067989 -0.778599
C 2.999881 0.237298 -0.325871
C 1.862030 0.155684 0.707729
C -0.600329 0.344948 0.645216
C -1.839720 0.511629 -0.252343
C 8.950743 -1.050421 0.112504
C -7.302808 -0.358967 0.486783
C -6.630963 0.977378 0.725198
C -4.263107 0.774614 0.103270
C -7.217763 -0.988499 -0.782735
C -8.026204 -0.996407 1.526393
C -7.842985 -2.235580 -1.003316
C -8.652691 -2.243815 1.306728
C -8.562395 -2.865820 0.039666
H 5.300013 -0.483331 -1.537168
H 6.648668 1.512415 -1.914220
H 4.911909 1.909714 -1.852124
H 5.210139 2.725379 0.546315
H 6.949550 2.381640 0.441981
H 4.433860 0.005798 1.187923
H 6.514617 4.823586 -0.000477
H 5.417292 4.405946 -1.347291
H 7.162533 4.050367 -1.475485
H 1.967391 0.949606 1.472834
H 1.899715 -0.810194 1.250072
H 0.692359 0.381720 -1.032721
H -1.749753 1.431508 -0.863848
H -1.908657 -0.335400 -0.964486
H 9.726787 -1.118000 -0.661490
H 8.738849 -2.037695 0.554755
H 9.238740 -0.345695 0.909866
H -2.843846 0.466285 1.618706
H -7.084076 1.516023 1.572635
H -6.643460 1.604138 -0.183460
H -6.646700 -0.499270 -1.579871
H -8.094691 -0.515277 2.510032
H -7.772176 -2.714594 -1.986448
H -9.210245 -2.727226 2.116934
H -9.049501 -3.832326 -0.133588


