%chk=000245460.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245460

0 1
O -0.117170 -1.801058 -0.169103
O 3.651378 1.203995 -0.769838
N -1.377383 0.091806 0.039734
C -2.663449 -0.690992 0.021731
C -1.479620 1.582195 0.130318
C -0.157105 -0.577759 -0.107207
C -2.716591 -1.646831 1.218109
C -2.813818 -1.442482 -1.305486
C -2.329522 1.995989 1.338345
C -2.036891 2.160016 -1.176152
C 1.109998 0.256538 -0.204853
C 2.337597 -0.591529 0.119675
C 3.624608 0.106913 -0.257927
C 4.881415 -0.660318 0.043938
H -3.504128 0.049040 0.112352
H -0.442013 1.995133 0.289317
H -3.664197 -2.191886 1.248130
H -1.908710 -2.395398 1.157000
H -2.595224 -1.117376 2.167455
H -2.748315 -0.769267 -2.165111
H -3.771049 -1.969117 -1.355673
H -2.018825 -2.198084 -1.421591
H -2.304549 3.082346 1.478419
H -3.381771 1.706747 1.227697
H -1.963579 1.531461 2.262147
H -1.430647 1.856960 -2.038336
H -2.049745 3.255166 -1.148926
H -3.061999 1.826519 -1.373858
H 1.075984 1.150582 0.454329
H 1.198255 0.665849 -1.237798
H 2.345347 -0.866331 1.194330
H 2.261220 -1.572901 -0.408413
H 4.978519 -0.889886 1.112168
H 5.774286 -0.087369 -0.249631
H 4.916894 -1.614674 -0.497591


%chk=000245460-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245460

0 1
O -0.046527 -1.820394 -0.118180
O 3.542138 0.979061 -1.212849
N -1.372991 0.088104 0.020754
C -2.634318 -0.725362 -0.081695
C -1.521435 1.575381 0.087268
C -0.141669 -0.552624 0.015070
C -2.795639 -1.693005 1.114496
C -2.750177 -1.452020 -1.442888
C -2.248196 2.020135 1.380490
C -2.203975 2.141228 -1.183063
C 1.131791 0.306679 0.168876
C 2.387521 -0.572166 0.285309
C 3.617235 0.013417 -0.403689
C 4.952161 -0.644211 -0.073183
H -3.456652 0.012251 -0.024142
H -0.504487 1.996596 0.118338
H -3.773060 -2.205840 1.047966
H -1.996466 -2.450365 1.104887
H -2.757120 -1.145076 2.073422
H -2.665772 -0.737801 -2.281477
H -3.732716 -1.954666 -1.514454
H -1.956051 -2.208403 -1.541705
H -2.276726 3.123539 1.437624
H -3.291737 1.657339 1.408649
H -1.727072 1.638328 2.276319
H -1.650441 1.844565 -2.091156
H -2.225207 3.245204 -1.135281
H -3.247380 1.791354 -1.283399
H 1.046013 0.972965 1.047534
H 1.260002 0.965517 -0.714460
H 2.635511 -0.811266 1.337417
H 2.159150 -1.557549 -0.178655
H 5.301781 -0.286771 0.915533
H 5.708564 -0.377653 -0.827709
H 4.853151 -1.742493 -0.004267


