%chk=000202402.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202402

0 1
O 1.838783 -0.589921 -0.005004
O 2.769480 1.523440 0.244254
O 5.687088 0.062730 -1.432816
N -3.681700 0.488039 0.240763
N 4.054304 -0.436097 0.232552
C -2.263354 0.148663 0.168120
C -1.386449 1.255907 0.299451
C -1.739609 -1.152035 -0.016848
C 0.002563 1.061144 0.249000
C -0.351997 -1.343772 -0.064273
C 0.483963 -0.230224 0.069712
C -1.917161 2.637206 0.491573
C -2.615948 -2.355728 -0.152771
C -4.397501 0.186442 -1.033083
C -4.353235 -0.135426 1.418442
C 2.879564 0.327852 0.144952
C 5.353731 0.206613 -0.059626
H 0.683851 1.910607 0.345156
H 0.079378 -2.331093 -0.201990
H -2.549733 2.691870 1.392031
H -1.129892 3.394161 0.582753
H -2.571124 2.924807 -0.347287
H -2.091009 -3.206353 -0.607895
H -2.975610 -2.688424 0.832078
H -3.501220 -2.154194 -0.780383
H -3.886940 0.709571 -1.858387
H -5.420696 0.587583 -0.966292
H -4.455805 -0.885976 -1.290261
H -3.744563 0.044098 2.319582
H -4.539053 -1.215222 1.339484
H -5.320665 0.372142 1.566489
H 3.975589 -1.441312 0.064446
H 6.131714 -0.256092 0.582800
H 5.294525 1.313924 0.077612
H 5.912631 -0.857928 -1.670833


%chk=000202402-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202402

0 1
O 1.916480 -0.655256 0.062625
O 2.854873 1.538880 0.115825
O 5.905797 0.429210 -1.428773
N -3.702753 0.205903 0.260127
N 4.154213 -0.420808 0.073463
C -2.286367 0.006230 0.191245
C -1.419370 1.146010 0.142751
C -1.717715 -1.311260 0.180587
C -0.014067 0.975490 0.087246
C -0.313934 -1.458750 0.157382
C 0.523461 -0.326944 0.108154
C -1.982809 2.554579 0.185635
C -2.591921 -2.553395 0.135077
C -4.436195 0.765003 -0.879642
C -4.516231 -0.425160 1.300425
C 2.963154 0.293607 0.081622
C 5.444554 0.239774 -0.048958
H 0.645505 1.844208 0.058342
H 0.141187 -2.454538 0.145256
H -2.911993 2.578457 0.781679
H -1.252828 3.257339 0.622195
H -2.234857 2.932470 -0.825035
H -2.009925 -3.427669 -0.203300
H -3.021914 -2.804749 1.123348
H -3.439757 -2.412236 -0.558868
H -3.737776 1.256655 -1.575680
H -5.180388 1.519907 -0.548806
H -4.986457 -0.016868 -1.453853
H -3.882941 -0.690480 2.163513
H -5.050362 -1.344823 0.965524
H -5.287152 0.289862 1.657251
H 4.080615 -1.439169 0.069505
H 6.186381 -0.335467 0.539686
H 5.349142 1.262212 0.343002
H 6.066253 -0.451224 -1.855048


