$molecule 0 1 C 0.08019940 0.00218766 6.94120425 C 0.14226504 0.00705625 8.34008844 C 0.18792640 -1.17080638 9.07179209 C 0.15187943 -2.41719423 8.37539133 C 0.08871944 -2.41712475 6.95471555 C 0.06220358 -1.18844449 6.24982268 C 0.03357677 -1.17174218 4.76974119 N 0.02193732 -2.41699029 4.15967319 C 0.03210806 -3.66232024 4.76965125 C 0.06122097 -3.64575655 6.24975915 C 0.07845859 -4.83640222 6.94111956 C 0.14101744 -4.84163436 8.33998815 C 0.18772545 -3.66373189 9.07156601 C 0.28259277 -3.66382703 10.54291921 C 0.32649859 -2.41741334 11.23742728 C 0.28178563 -1.17087680 10.54321639 C 0.34353566 0.00646797 11.27315701 C 0.44382131 0.00204757 12.67027620 C 0.48580410 -1.18896822 13.35869200 C 0.42957488 -2.41753422 12.65530545 C 0.48737944 -3.64625522 13.35827853 C 0.44681317 -4.83715152 12.66957460 C 0.34605164 -4.84131894 11.27248501 H 0.32937195 -5.80454080 10.76697579 H 0.50078082 -5.77077301 13.23008547 C 0.60730436 -3.66273813 14.83557977 N 0.63837656 -2.41782122 15.44481422 C 0.60540843 -1.17272401 14.83603785 O 0.68009170 -0.15618685 15.49794635 H 0.73167711 -2.41792807 16.45512501 O 0.68377993 -4.67938835 15.49710993 H 0.49637842 0.93558744 13.23105421 H 0.32573516 0.96981688 10.76793886 H 0.16272650 -5.80440249 8.84632959 H 0.05169882 -5.77009731 6.37852815 O 0.02615317 -4.67874599 4.10154920 H 0.00354128 -2.41696114 3.14508379 O 0.02928999 -0.15524938 4.10172357 H 0.16448831 0.96977567 8.84648583 H 0.05436008 0.93597657 6.37870709 $end $rem METHOD lrc-wpbeh BASIS 6-31g* CIS_N_ROOTS 4 CIS_SINGLETS true CIS_TRIPLETS false CIS_CONVERGENCE 6 MAX_CIS_CYCLES 100 MAX_CIS_SUBSPACE 40 print_orbitals 4 molden_format true $end