%chk=000240062.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240062

0 1
O 8.011854 -1.935823 1.426508
O -8.010518 -1.936810 -1.433419
O 6.173094 1.263743 0.246647
O -6.174001 1.259554 -0.241436
N 4.591671 0.406872 -1.238252
N -4.591435 0.398143 1.239615
N 6.854252 -0.335472 -1.279162
N -6.853389 -0.346234 1.278249
C -0.001409 3.620896 0.006361
C 1.212157 2.784104 -0.299103
C -1.214172 2.781869 0.308874
C 2.383735 2.920929 0.458502
C -2.386066 2.920660 -0.447889
C 1.184468 1.864700 -1.360285
C -1.185431 1.858365 1.366457
C 3.479228 1.244037 -0.894769
C -3.479787 1.237582 0.899120
C 3.516549 2.159846 0.168797
C -3.518159 2.157499 -0.160859
C 2.305663 1.096532 -1.665086
C -2.305901 1.088067 1.668551
C 8.136197 -0.524768 -0.550093
C -8.135388 -0.533713 0.548805
C 5.879965 0.501159 -0.657174
C -5.879977 0.493657 0.659288
C 8.244580 -1.881391 0.041748
C -8.242811 -1.888071 -0.048375
C 8.516764 -3.136892 -0.442643
C -8.513758 -3.145716 0.431125
C 8.456710 -4.038358 0.681135
C -8.453288 -4.042670 -0.696236
C 8.153568 -3.279419 1.781675
C -8.151206 -3.279107 -1.793865
H -0.194194 4.302338 -0.851442
H 0.190716 4.299493 0.866566
H 2.420530 3.629292 1.286130
H -2.423673 3.632212 -1.272738
H 0.273125 1.746883 -1.947697
H -0.273838 1.739028 1.953175
H 4.426358 2.281334 0.767649
H -4.428229 2.280553 -0.758994
H 2.263952 0.390543 -2.490330
H -2.263374 0.378905 2.491028
H 4.454325 -0.194586 -2.051471
H -4.453358 -0.206395 2.050423
H 8.965667 -0.350055 -1.279800
H 8.240348 0.263484 0.247198
H -8.964790 -0.362584 1.279438
H -8.240429 0.257603 -0.245328
H 6.547180 -1.159114 -1.795517
H -6.545482 -1.171655 1.791253
H 8.744451 -3.420920 -1.451124
H -8.740854 -3.433937 1.438548
H 8.624828 -5.096883 0.634122
H -8.620466 -5.101519 -0.653362
H 8.002633 -3.455832 2.823359
H -8.000483 -3.451256 -2.836293


%chk=000240062-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240062

0 1
O 8.224758 -2.559797 0.962135
O -8.221118 -2.565456 -0.971260
O 6.404663 1.338176 0.678299
O -6.404087 1.334677 -0.676435
N 4.857324 0.436594 -0.868350
N -4.857925 0.429867 0.869512
N 7.070761 -0.325751 -0.819733
N -7.070709 -0.333991 0.816089
C -0.001066 3.503271 0.008251
C 1.274603 2.685039 -0.185384
C -1.276326 2.683509 0.197874
C 2.446834 2.965777 0.557309
C -2.448026 2.965809 -0.545060
C 1.335047 1.637038 -1.140086
C -1.336917 1.632218 1.148962
C 3.693844 1.210533 -0.597000
C -3.694798 1.205641 0.601975
C 3.648384 2.248597 0.369333
C -3.649184 2.247004 -0.360783
C 2.522492 0.911929 -1.347022
C -2.523983 0.905462 1.352216
C 8.431595 -0.400249 -0.263410
C -8.430762 -0.408164 0.257809
C 6.122044 0.542251 -0.268154
C -6.122031 0.536342 0.268155
C 8.897406 -1.804447 -0.026716
C -8.895481 -1.812192 0.018019
C 9.915259 -2.574045 -0.571290
C -9.913602 -2.583305 0.559942
C 9.890452 -3.861904 0.094102
C -9.887199 -3.870002 -0.107633
C 8.854950 -3.816219 1.010687
C -8.850534 -3.822151 -1.022788
H -0.144085 4.173844 -0.863030
H 0.141687 4.169696 0.882744
H 2.426754 3.766871 1.307166
H -2.427848 3.769481 -1.292145
H 0.439730 1.384258 -1.720078
H -0.442014 1.378160 1.729044
H 4.542018 2.472506 0.954259
H -4.542378 2.472146 -0.945913
H 2.543129 0.107431 -2.094857
H -2.544735 0.098408 2.097289
H 4.736021 -0.283792 -1.583257
H -4.736787 -0.292865 1.582076
H 9.162805 0.090295 -0.935586
H 8.403017 0.185675 0.674069
H -9.163139 0.080781 0.929888
H -8.401292 0.179484 -0.678562
H 6.839449 -0.942875 -1.599248
H -6.840014 -0.952736 1.594502
H 10.605031 -2.257656 -1.351880
H -10.604565 -2.268657 1.340183
H 10.554275 -4.704947 -0.086316
H -10.550776 -4.713730 0.070471
H 8.445715 -4.519339 1.730592
H -8.439967 -4.523797 -1.743372


