%chk=000206990.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206990

0 1
I -2.418406 -1.570395 -2.105739
O -0.278106 -0.243127 -0.300460
O -0.638358 0.850002 1.716308
O 0.845287 -4.119336 0.487773
O -0.730256 -2.570403 1.057157
N 1.628222 1.739005 -0.546775
N 0.449331 -2.899916 0.662078
C 2.052329 0.474395 -0.172663
C 3.444044 0.134367 0.029130
C 1.049901 -0.539212 0.027286
C 1.443371 -1.829855 0.410454
C 3.802115 -1.202147 0.400288
C 2.820811 -2.170303 0.579209
C 4.407890 1.177157 -0.163452
C -2.434838 0.780152 0.079604
C 3.974712 2.451484 -0.531636
C -1.074624 0.485278 0.615915
C 2.571596 2.683526 -0.713573
C -3.124874 0.130826 -0.985760
C -3.093251 1.850831 0.756339
C -4.420522 0.568434 -1.355672
C -4.376237 2.284653 0.385886
C -5.041867 1.641252 -0.681837
H 4.857928 -1.455317 0.545010
H 3.065361 -3.199944 0.851978
H 5.472188 0.960581 -0.019224
H 4.682473 3.271420 -0.685916
H 2.212254 3.677090 -1.005402
H -2.554392 2.324113 1.583388
H -4.947751 0.064164 -2.170157
H -4.851905 3.112099 0.921526
H -6.043027 1.960925 -0.990064


%chk=000206990-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206990

0 1
I -1.597702 -0.019587 -2.889032
O -0.341385 -0.367327 -0.065217
O -0.539778 1.186684 1.664688
O 0.857455 -4.139718 0.988370
O -0.678263 -2.546936 1.546572
N 1.534100 1.585021 -0.660839
N 0.466665 -2.909345 1.084109
C 1.989295 0.371190 -0.175265
C 3.392506 0.054171 -0.029649
C 1.006927 -0.617298 0.192038
C 1.433634 -1.867577 0.662860
C 3.783278 -1.240888 0.442639
C 2.821729 -2.189508 0.770949
C 4.333604 1.073441 -0.389051
C -2.363019 0.945999 0.065079
C 3.868450 2.300829 -0.863037
C -1.014861 0.667967 0.638825
C 2.455524 2.508239 -0.987933
C -2.812766 0.714008 -1.266777
C -3.279737 1.516546 0.997818
C -4.145909 1.027127 -1.627015
C -4.602747 1.824180 0.640440
C -5.039563 1.570682 -0.679314
H 4.847866 -1.478303 0.542448
H 3.090407 -3.189725 1.119757
H 5.406495 0.875074 -0.289309
H 4.558835 3.101275 -1.145154
H 2.070345 3.461245 -1.368123
H -2.911163 1.703339 2.011591
H -4.485335 0.850146 -2.651445
H -5.285840 2.252470 1.380492
H -6.067649 1.798378 -0.980516


