%chk=000272852.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272852

0 1
O -2.676401 0.849749 1.152768
O 2.181761 2.375973 0.563622
O 0.735756 -0.511868 2.014773
O 0.558882 3.562090 -0.399282
N -2.773171 0.983038 -1.236158
C -2.207031 0.214449 -0.057665
C -0.749664 0.683955 -0.443167
C -1.407811 1.566398 -1.541187
C 0.002599 1.397801 0.670439
C -3.787223 1.927339 -0.695303
C -2.462251 -1.257105 0.040111
C -3.590679 1.935937 0.834167
C 0.981829 0.480094 1.391531
C 0.847812 2.557423 0.186262
C 2.392531 1.086246 1.210485
C -3.241868 -1.917480 -0.918792
C -1.907862 -1.973039 1.111896
C 3.290025 0.228905 0.359711
C -3.464010 -3.293077 -0.804601
C -2.135369 -3.346715 1.220970
C -2.912865 -4.007551 0.263621
C 3.468391 -1.122198 0.693494
C 3.965754 0.780619 -0.735875
C 4.321543 -1.916997 -0.074742
C 4.817361 -0.021902 -1.500660
C 4.996430 -1.368874 -1.171625
H -0.144678 -0.142462 -0.867104
H -1.297290 2.655260 -1.407219
H -1.111709 1.313082 -2.573109
H -0.764078 1.776533 1.417568
H -4.787208 1.526928 -0.974613
H -3.705019 2.935168 -1.143884
H -3.115880 2.853309 1.214189
H -4.507154 1.708335 1.401664
H 2.870079 1.339691 2.186092
H -3.671330 -1.358291 -1.752463
H -1.299177 -1.452953 1.858082
H -4.068574 -3.806932 -1.549450
H -1.706375 -3.901651 2.053411
H -3.088801 -5.078220 0.350801
H 2.936383 -1.553325 1.544396
H 3.825082 1.835515 -0.984493
H 4.460281 -2.966748 0.181297
H 5.342787 0.406408 -2.353409
H 5.661089 -1.992059 -1.768148


%chk=000272852-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272852

0 1
O -2.716548 0.938650 1.165654
O 2.308170 2.437172 0.735402
O 0.708882 -0.379557 2.290851
O 0.620437 3.817019 -0.044922
N -2.645636 0.992971 -1.245354
C -2.097267 0.284224 -0.037274
C -0.665173 0.900637 -0.349304
C -1.390953 1.848917 -1.362727
C 0.055167 1.554997 0.860448
C -3.894699 1.669622 -0.802266
C -2.286087 -1.212792 0.057670
C -3.632259 2.013697 0.691569
C 1.004750 0.604258 1.581231
C 0.945545 2.728712 0.452346
C 2.457143 1.075605 1.306367
C -2.631130 -1.951605 -1.100054
C -2.095386 -1.887609 1.289986
C 3.198775 0.142363 0.348372
C -2.797464 -3.353363 -1.025348
C -2.259098 -3.287263 1.359857
C -2.611402 -4.025145 0.204319
C 3.449802 -1.194917 0.747429
C 3.637334 0.595017 -0.918562
C 4.134112 -2.072522 -0.120884
C 4.323682 -0.288812 -1.782720
C 4.573443 -1.622636 -1.388430
H -0.011843 0.169316 -0.853117
H -1.502933 2.885241 -0.993966
H -0.981228 1.869346 -2.384495
H -0.748644 1.895597 1.546375
H -4.734703 0.960272 -0.900127
H -4.097219 2.555950 -1.425356
H -3.139923 2.999466 0.808073
H -4.536412 1.973591 1.320136
H 3.002542 1.177223 2.262080
H -2.777255 -1.412577 -2.042295
H -1.821980 -1.317047 2.182222
H -3.071843 -3.918640 -1.923388
H -2.111203 -3.803607 2.315014
H -2.738744 -5.112232 0.263035
H 3.097398 -1.549903 1.722547
H 3.458900 1.633821 -1.212428
H 4.322422 -3.105575 0.191067
H 4.665907 0.068045 -2.760411
H 5.105520 -2.305128 -2.060221


