%chk=000195998.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195998

0 1
O -4.707994 1.314606 0.216285
N 0.109027 -1.482906 -0.220144
N 2.559332 -3.067415 -0.065210
C 1.335244 -0.886771 0.420573
C 2.565591 -1.590657 -0.236999
C 0.034251 -2.956981 0.044888
C 1.521653 0.612086 0.259475
C -1.126024 -0.779047 0.042955
C 1.279088 -3.634476 -0.570516
C 0.880299 1.426078 -0.690964
C -0.203526 0.895497 -1.591288
C -1.332346 0.399133 -0.731654
C 2.464776 1.199606 1.126165
C -2.131163 -1.231118 0.905397
C 1.213804 2.789275 -0.782128
C -2.540413 1.082033 -0.651662
C 2.787053 2.552508 1.033827
C -3.354740 -0.555104 0.990715
C 2.164925 3.350699 0.067889
C -3.539363 0.586284 0.206563
H 1.327052 -1.111779 1.523295
H 2.577766 -1.363844 -1.327489
H 3.510392 -1.186457 0.180998
H -0.882080 -3.349507 -0.448877
H -0.043717 -3.202615 1.124872
H 1.262174 -4.725207 -0.369203
H 1.263490 -3.511479 -1.678144
H 2.674380 -3.302011 0.927219
H -0.548751 1.659801 -2.314821
H 0.194974 0.056978 -2.213330
H 2.955738 0.589917 1.884415
H -1.978407 -2.114381 1.523242
H 0.717793 3.415884 -1.522272
H -2.731962 1.984815 -1.227601
H 3.519876 2.986278 1.711135
H -4.132386 -0.914800 1.654949
H 2.416937 4.406290 -0.014367
H -5.373842 0.936289 0.839110


%chk=000195998-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000195998

0 1
O -4.818514 1.338924 0.137623
N 0.099809 -1.493138 -0.052711
N 2.556474 -3.063301 -0.225972
C 1.386329 -0.887424 0.417327
C 2.561326 -1.593645 -0.355293
C 0.067694 -2.954495 0.186819
C 1.550159 0.626996 0.300292
C -1.135997 -0.781923 0.083185
C 1.235797 -3.639490 -0.564375
C 0.926891 1.436859 -0.692364
C -0.181522 0.870545 -1.574842
C -1.334256 0.394918 -0.706791
C 2.484886 1.228424 1.182895
C -2.205406 -1.252415 0.886694
C 1.270618 2.807683 -0.781538
C -2.561523 1.080727 -0.653819
C 2.823007 2.594603 1.085972
C -3.444852 -0.574529 0.921351
C 2.216873 3.391080 0.089283
C -3.616628 0.599263 0.155031
H 1.518113 -1.149771 1.499825
H 2.470184 -1.329707 -1.426698
H 3.525558 -1.199253 0.010867
H -0.895176 -3.349212 -0.184325
H 0.141701 -3.197341 1.278129
H 1.244718 -4.722839 -0.343684
H 1.073518 -3.513370 -1.651815
H 2.877826 -3.364931 0.705036
H -0.522203 1.638536 -2.290579
H 0.198708 0.003361 -2.150810
H 2.952807 0.611781 1.961504
H -2.075594 -2.150355 1.499430
H 0.778019 3.426983 -1.541063
H -2.724432 1.984131 -1.250341
H 3.545176 3.033076 1.783473
H -4.260776 -0.956355 1.549248
H 2.466447 4.454174 -0.000159
H -5.486858 0.928930 0.740496


