%chk=000182912.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182912

0 1
O -0.821250 -0.722866 -0.048176
O -3.867173 0.419056 0.520464
N -5.664210 -1.040166 0.082462
C 5.548374 -0.010526 0.357666
C 4.627123 0.696275 -0.664728
C 6.930617 0.675738 0.411611
C 5.654119 -1.516761 0.044134
C 3.179502 0.342817 -0.468397
C 7.693566 0.671114 -0.910416
C 6.295597 -2.310582 1.179632
C 2.540531 -0.555010 -1.345996
C 2.451070 0.905546 0.587006
C 1.201604 -0.885735 -1.175145
C 1.101649 0.589601 0.783174
C 0.493693 -0.304569 -0.103290
C -1.664523 -0.184033 1.011521
C -3.030877 -0.780031 0.696079
C -5.175958 0.227720 0.193476
C -5.940763 1.403217 -0.001393
C -7.279614 1.233684 -0.330529
C -7.815842 -0.059656 -0.454762
C -6.982586 -1.163433 -0.242672
H 5.085476 0.098567 1.371385
H 4.755846 1.795030 -0.579971
H 4.955231 0.450167 -1.694092
H 7.543550 0.174424 1.188118
H 6.803841 1.719430 0.760126
H 6.227688 -1.667813 -0.890535
H 4.639635 -1.918657 -0.154403
H 8.695372 1.097668 -0.788606
H 7.179123 1.256612 -1.679944
H 7.814487 -0.347689 -1.298645
H 6.335273 -3.378898 0.939277
H 5.732101 -2.206207 2.113696
H 7.322249 -1.979689 1.374585
H 3.100763 -0.996388 -2.170244
H 2.936877 1.601513 1.270543
H 0.691279 -1.574962 -1.843542
H 0.558308 1.039156 1.606156
H -1.679031 0.922522 0.947337
H -1.261658 -0.514493 1.983199
H -3.457817 -1.386111 1.511627
H -3.029463 -1.358961 -0.249744
H -5.478894 2.379832 0.103380
H -7.916821 2.104044 -0.493793
H -8.861155 -0.199039 -0.712695
H -7.353610 -2.191859 -0.328337


%chk=000182912-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182912

0 1
O -0.968139 -0.459168 0.178147
O -3.794256 0.436504 0.340957
N -5.742675 -0.892029 0.568725
C 5.591013 -0.027426 0.348970
C 4.621463 0.849234 -0.509751
C 7.039882 0.540266 0.306077
C 5.499503 -1.523795 -0.052891
C 3.147097 0.526146 -0.310754
C 7.739896 0.470162 -1.071037
C 6.352755 -2.469806 0.820335
C 2.393296 -0.147689 -1.309217
C 2.479136 0.879155 0.887712
C 1.033155 -0.459524 -1.121874
C 1.114843 0.575681 1.099210
C 0.388677 -0.099458 0.086288
C -1.689710 -0.076428 1.398065
C -3.129828 -0.529951 1.245923
C -5.119484 0.178935 0.016478
C -5.743049 1.081053 -0.887731
C -7.086755 0.841624 -1.223285
C -7.762581 -0.273681 -0.659224
C -7.049507 -1.105743 0.225754
H 5.248309 0.049160 1.404979
H 4.807495 1.912318 -0.252853
H 4.882429 0.731278 -1.579399
H 7.659722 0.002975 1.050511
H 7.008813 1.597887 0.640643
H 5.789101 -1.638638 -1.117720
H 4.438607 -1.834668 0.009421
H 8.754772 0.905129 -1.014042
H 7.181940 1.030670 -1.843044
H 7.844880 -0.573033 -1.421038
H 6.172601 -3.526657 0.549693
H 6.103635 -2.350422 1.892187
H 7.434897 -2.276194 0.703533
H 2.880537 -0.429267 -2.250664
H 3.031398 1.409135 1.674385
H 0.452241 -0.974544 -1.893227
H 0.637815 0.871229 2.038656
H -1.645999 1.021262 1.546309
H -1.234779 -0.579922 2.277275
H -3.649783 -0.529619 2.222083
H -3.189478 -1.546216 0.819328
H -5.174461 1.920354 -1.295576
H -7.604556 1.511948 -1.917425
H -8.807186 -0.489213 -0.900669
H -7.524384 -1.979413 0.686378


