%chk=000289615.chk %nprocshared=4 %mem=7GB #p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm 000289615 0 1 O -3.754813 -0.835395 -0.683394 N -1.181778 0.092433 -0.245237 N -2.224399 0.433650 0.590776 N -4.527332 0.304380 1.157293 C 2.057560 -1.127988 -0.309646 C 1.147671 0.010887 -0.842571 C 2.783266 -0.709982 0.986558 C 1.983743 1.283304 -1.099159 C 1.267923 -2.421151 -0.104693 C 3.335276 0.681705 0.915509 C 2.969275 1.576058 -0.008237 C 0.037124 0.331283 0.136781 C -3.510427 -0.099055 0.244899 H 2.837272 -1.309746 -1.093146 H 0.701303 -0.325096 -1.815197 H 3.598947 -1.430943 1.196630 H 2.095143 -0.783408 1.853890 H 1.308675 2.150386 -1.249670 H 2.535114 1.169456 -2.057206 H 0.490252 -2.313512 0.660322 H 0.756083 -2.727082 -1.026171 H 1.919612 -3.246617 0.199133 H 4.062579 0.925765 1.688671 H 3.388766 2.580896 -0.028781 H 0.371046 0.751539 1.093146 H -2.049804 0.739339 1.555609 H -4.461659 1.188214 1.637840 H -5.474118 0.083979 0.862452 %chk=000289615-Freq.chk %nprocshared=4 %mem=7GB #p freq=noraman PBEPBE/SDD 000289615 0 1 O -3.933090 -0.664679 -0.770929 N -1.215993 -0.022029 -0.311121 N -2.239714 0.325504 0.558234 N -4.484646 0.445528 1.204909 C 2.087659 -1.147054 -0.303027 C 1.163220 -0.024539 -0.887537 C 2.720005 -0.698602 1.040874 C 2.016923 1.248891 -1.162243 C 1.358562 -2.498915 -0.168276 C 3.228075 0.731517 1.004358 C 2.920284 1.603887 0.007411 C 0.006140 0.308564 0.028156 C -3.577726 -0.016253 0.244597 H 2.915584 -1.265579 -1.034153 H 0.726833 -0.390336 -1.835838 H 3.554864 -1.381762 1.298032 H 1.981697 -0.817474 1.864275 H 1.354771 2.104296 -1.402881 H 2.634179 1.081857 -2.070074 H 0.498118 -2.420843 0.521546 H 0.967515 -2.842667 -1.143279 H 2.040634 -3.278163 0.221450 H 3.879905 1.057036 1.827459 H 3.340485 2.619328 0.025805 H 0.243375 0.853957 0.967141 H -2.028954 0.827260 1.434437 H -4.232911 1.011781 2.012414 H -5.463496 0.222788 1.044663