%chk=000215914.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215914

0 1
O 4.930224 2.746853 0.142071
N -1.872271 -0.944508 0.702421
N -3.925403 -0.674177 -0.288428
N 0.367830 -1.840620 0.229025
N 5.863791 1.218347 -1.255520
N 7.080233 1.947456 -1.363179
C -3.072899 -1.571497 0.217392
C -3.288709 -3.060162 0.310955
C -2.009056 0.440379 0.438385
C -0.679299 -1.614616 1.252365
C -3.302500 0.591324 -0.170512
C -3.244686 -3.664910 -1.096165
C -4.622853 -3.345430 1.006121
C -1.172499 1.542787 0.665324
C -3.762772 1.864263 -0.546645
C 1.420270 -0.905338 0.061363
C -1.652295 2.787584 0.281313
C -2.927760 2.947226 -0.313829
C 1.915874 -0.154353 1.150105
C 2.049021 -0.809233 -1.203097
C 3.022930 0.668536 0.972717
C 3.159190 0.012747 -1.361930
C 3.661248 0.748158 -0.276628
C 4.826423 1.659284 -0.405054
H -2.465178 -3.516413 0.924141
H -0.987797 -2.623460 1.643212
H -0.274795 -1.015572 2.108682
H -4.025732 -3.228727 -1.737561
H -3.414501 -4.746930 -1.068976
H -2.285046 -3.485809 -1.590209
H -4.651503 -2.923235 2.017023
H -4.813456 -4.420801 1.081028
H -5.462607 -2.897695 0.452417
H -0.189818 1.427300 1.113012
H 0.001019 -2.240090 -0.641043
H -4.744259 1.974574 -1.003987
H -1.034144 3.672356 0.436312
H -3.250971 3.949116 -0.593475
H 1.444917 -0.224958 2.128927
H 1.666153 -1.369550 -2.052926
H 3.403737 1.264881 1.807753
H 3.629298 0.096388 -2.344535
H 5.991526 0.233701 -1.498742
H 6.925171 2.739253 -2.004714
H 7.321153 2.377770 -0.456208


%chk=000215914-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215914

0 1
O 5.559311 2.234336 0.686044
N -2.004401 -0.908017 0.616600
N -4.228961 -0.683109 0.116386
N 0.267683 -1.486273 -0.097678
N 6.084760 1.247394 -1.345530
N 7.340345 1.907732 -1.448962
C -3.256399 -1.554529 0.428248
C -3.442889 -3.053553 0.534327
C -2.216342 0.470004 0.401740
C -0.716624 -1.524896 0.978184
C -3.611559 0.589742 0.092748
C -2.891944 -3.773561 -0.731468
C -4.933617 -3.399347 0.752911
C -1.354483 1.584948 0.451463
C -4.172161 1.859040 -0.170604
C 1.463239 -0.756260 -0.115101
C -1.933760 2.845407 0.187034
C -3.319272 2.981652 -0.118735
C 2.020171 -0.133350 1.042333
C 2.173423 -0.639152 -1.348454
C 3.232301 0.571432 0.955107
C 3.387941 0.060607 -1.419112
C 3.946433 0.676237 -0.265360
C 5.230393 1.445972 -0.258313
H -2.874984 -3.423213 1.414230
H -0.929435 -2.566561 1.274715
H -0.302281 -1.005634 1.856846
H -3.429945 -3.423771 -1.630348
H -3.037206 -4.865399 -0.642786
H -1.811179 -3.590956 -0.883697
H -5.320756 -2.926997 1.671682
H -5.060055 -4.494368 0.833588
H -5.540754 -3.025782 -0.088142
H -0.284635 1.495110 0.665630
H -0.026354 -1.903115 -0.982811
H -5.236770 1.953958 -0.404836
H -1.300284 3.738870 0.212624
H -3.725162 3.979168 -0.319282
H 1.528526 -0.209811 2.017191
H 1.751136 -1.087822 -2.256303
H 3.657607 1.058934 1.838741
H 3.872089 0.156290 -2.398286
H 5.935105 0.500263 -2.022662
H 7.195840 2.909209 -1.645234
H 7.863106 1.801369 -0.565969


