%chk=000289647.chk %nprocshared=4 %mem=7GB #p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm 000289647 0 1 O -1.683897 -0.973146 -1.651864 O -3.172797 -1.789630 -0.178619 N -0.372731 1.082721 0.586200 N 1.535564 2.090443 -0.209447 N -4.073730 0.988646 0.168472 N 0.490384 -1.269033 0.758943 N 2.838320 -1.451012 0.083349 N 4.116543 0.389721 -0.669590 C -1.769631 0.913100 0.998658 C -2.692314 0.633299 -0.219144 C 0.585604 0.071313 0.470628 C 1.774959 0.720189 -0.017291 C 0.261294 2.291565 0.140579 C -2.570604 -0.842712 -0.620850 C 2.926441 -0.104101 -0.207683 C 1.646834 -1.950363 0.544475 H -2.121526 1.839837 1.516963 H -1.836778 0.079452 1.743068 H -2.376221 1.274882 -1.089839 H -0.268022 3.234246 0.121689 H -4.456754 0.321087 0.838465 H -4.691817 1.002132 -0.639013 H 1.635624 -3.032756 0.763050 H 4.914696 -0.214199 -0.788133 H 4.211383 1.370120 -0.885803 H -1.505923 -1.925203 -1.893861 %chk=000289647-Freq.chk %nprocshared=4 %mem=7GB #p freq=noraman PBEPBE/SDD 000289647 0 1 O -1.545528 -0.688895 -1.784210 O -3.097319 -1.790453 -0.442640 N -0.360755 1.085368 0.510301 N 1.549436 2.037969 -0.346814 N -4.130234 0.773198 0.382537 N 0.472403 -1.226118 0.880057 N 2.831352 -1.471804 0.220100 N 4.113048 0.307110 -0.663333 C -1.749046 0.946806 0.961000 C -2.781296 0.653378 -0.180797 C 0.604546 0.072506 0.483811 C 1.775094 0.681719 -0.042960 C 0.263024 2.234817 -0.003793 C -2.519469 -0.737602 -0.787422 C 2.923056 -0.154927 -0.168527 C 1.636635 -1.923686 0.714313 H -2.080284 1.883442 1.438921 H -1.785970 0.135512 1.709398 H -2.640609 1.410132 -0.971746 H -0.264771 3.182779 -0.091366 H -4.412808 -0.062626 0.908738 H -4.843971 1.041776 -0.301100 H 1.615296 -2.976121 1.012917 H 4.902504 -0.332084 -0.727300 H 4.198341 1.278829 -0.953439 H -1.327774 -1.610423 -2.093243