%chk=000248201.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248201

0 1
O -1.835491 -2.608583 0.023602
O 5.394674 0.534578 -0.489523
O 5.085536 0.496198 1.775349
N -3.424904 -0.180322 -0.216325
N 0.991805 -0.301277 -0.250680
N 3.381190 1.244793 0.352711
C -5.852401 0.146734 -0.642759
C -4.439282 0.142967 -1.273031
C -5.921594 1.179383 0.498697
C -3.438751 0.851924 0.873393
C -4.827327 0.888929 1.531886
C -2.055866 -0.310377 -0.812063
C -1.248762 -1.292894 0.061757
C 0.175029 -1.532695 -0.485945
C 2.098808 -0.194888 -1.258596
C 1.552321 -0.288559 1.141882
C -6.905558 0.438246 -1.715116
C 2.859741 1.128563 -1.037543
C 2.316058 1.029699 1.376012
C 4.643467 0.696918 0.661717
C 6.802725 0.174540 -0.307476
C 6.922508 -1.293789 0.041550
H -6.044346 -0.868325 -0.213153
H -4.385659 -0.646691 -2.052766
H -4.243144 1.112293 -1.777005
H -5.807296 2.203250 0.097305
H -6.916615 1.149336 0.978619
H -3.165285 1.864804 0.506835
H -2.674723 0.563636 1.627481
H -4.839201 1.652117 2.331114
H -5.027604 -0.083121 2.025743
H -2.130073 -0.718816 -1.842507
H -1.501941 0.649982 -0.895215
H -1.233230 -0.970191 1.126643
H 0.117411 -1.760179 -1.571712
H 0.587505 -2.452263 -0.013435
H 2.806831 -1.050912 -1.223363
H 1.644910 -0.189342 -2.273265
H 0.703608 -0.353821 1.857665
H 2.215175 -1.155891 1.353507
H -6.879837 -0.308357 -2.516441
H -7.916042 0.422893 -1.291197
H -6.761851 1.421254 -2.176404
H 2.178819 1.995856 -1.202268
H 3.698985 1.219951 -1.763514
H 2.769479 1.040642 2.394019
H 1.622260 1.898817 1.308165
H -2.816599 -2.532294 0.100680
H 7.236726 0.832320 0.466710
H 7.202449 0.422341 -1.307832
H 7.968723 -1.620555 0.050582
H 6.506085 -1.494552 1.041871
H 6.377853 -1.926370 -0.669662


%chk=000248201-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248201

0 1
O -2.400781 -2.384446 0.410507
O 5.635730 0.521757 -0.798711
O 5.294545 1.047237 1.472710
N -3.548235 -0.032316 -0.070018
N 0.914861 -0.699636 -0.173521
N 3.495378 0.536252 0.054037
C -5.872436 0.379842 -0.925246
C -4.355453 0.523532 -1.188594
C -6.235170 1.050394 0.423142
C -3.857350 0.643494 1.221400
C -5.352404 0.506658 1.568715
C -2.086150 -0.086639 -0.359221
C -1.463445 -1.260009 0.447581
C -0.133094 -1.753043 -0.148102
C 1.979385 -0.986319 -1.168840
C 1.518607 -0.450018 1.162330
C -6.688668 0.964551 -2.096443
C 2.954513 0.202561 -1.277913
C 2.481303 0.750450 1.103556
C 4.829616 0.727156 0.342398
C 7.101203 0.652709 -0.565868
C 7.694762 -0.651062 -0.023857
H -6.089525 -0.705263 -0.838457
H -4.081667 -0.019186 -2.112786
H -4.120635 1.606688 -1.354330
H -6.088173 2.147615 0.329725
H -7.306587 0.888715 0.650124
H -3.581827 1.727071 1.168058
H -3.239834 0.183235 2.013592
H -5.559958 1.048645 2.511269
H -5.583075 -0.562337 1.743178
H -1.963221 -0.299102 -1.437737
H -1.559833 0.866844 -0.138951
H -1.310833 -0.945015 1.504470
H -0.335203 -2.075637 -1.186754
H 0.190251 -2.660736 0.416892
H 2.557829 -1.907489 -0.901426
H 1.507570 -1.154970 -2.154189
H 0.718207 -0.229320 1.890436
H 2.074881 -1.349850 1.529640
H -6.451763 0.456691 -3.050243
H -7.773681 0.853267 -1.915350
H -6.478809 2.044113 -2.225556
H 2.404780 1.079762 -1.677134
H 3.788050 -0.034045 -1.954402
H 3.003673 0.889104 2.063638
H 1.903257 1.668746 0.873751
H -3.289059 -1.921276 0.256924
H 7.273480 1.488484 0.134855
H 7.497971 0.904621 -1.563054
H 8.794186 -0.558297 0.056629
H 7.292330 -0.868910 0.979472
H 7.467800 -1.497375 -0.695628


