%chk=000245461.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245461

0 1
O -0.516986 -1.780369 0.158966
O 4.267671 -0.564400 -0.368591
O 3.385725 0.977883 1.031122
N -1.761742 0.121687 -0.070781
C -1.849904 1.611694 -0.183381
C -3.055675 -0.648904 -0.030993
C -0.549262 -0.558815 0.078076
C -2.386939 2.214491 1.120031
C -2.708549 2.014992 -1.388465
C -3.202675 -1.377609 1.308871
C -3.126200 -1.622182 -1.211842
C 0.729104 0.264688 0.155245
C 1.940284 -0.606065 -0.169052
C 3.213002 0.057952 0.266390
C 5.601661 -0.094113 -0.040388
H -0.810270 2.011518 -0.360158
H -3.889322 0.098393 -0.127028
H -2.390346 3.309230 1.076552
H -3.413210 1.894060 1.333752
H -1.775131 1.918594 1.980805
H -2.357548 1.532791 -2.309140
H -2.675273 3.098808 -1.545776
H -3.762443 1.737708 -1.262284
H -3.123415 -0.692260 2.157724
H -4.165116 -1.893269 1.375002
H -2.415555 -2.140574 1.430990
H -3.005956 -1.109323 -2.170481
H -4.079618 -2.157960 -1.227331
H -2.326249 -2.378889 -1.145027
H 0.695244 1.148517 -0.517013
H 0.826006 0.681202 1.185744
H 1.843331 -1.602028 0.337197
H 1.976480 -0.861667 -1.250647
H 6.221559 -0.578101 -0.802251
H 5.856757 -0.431036 0.968851
H 5.645556 0.997960 -0.107489


%chk=000245461-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245461

0 1
O -0.492583 -1.835334 0.096968
O 4.364403 -0.610542 -0.379596
O 3.349819 1.022929 0.931729
N -1.766283 0.111671 -0.024207
C -1.874104 1.602853 -0.071707
C -3.050297 -0.669735 0.040240
C -0.553140 -0.564083 -0.010957
C -2.568419 2.169062 1.192157
C -2.560539 2.085126 -1.373661
C -3.208801 -1.421615 1.383281
C -3.218052 -1.606273 -1.179616
C 0.745036 0.262547 -0.127264
C 1.970439 -0.659425 -0.257530
C 3.249974 0.030889 0.170374
C 5.683479 -0.068136 0.026689
H -0.845914 1.997586 -0.075515
H -3.851481 0.091014 -0.014072
H -2.555908 3.273790 1.162096
H -3.623779 1.849222 1.263126
H -2.045265 1.841277 2.107602
H -2.028504 1.703641 -2.263185
H -2.560282 3.189630 -1.414422
H -3.611871 1.749002 -1.431414
H -3.119233 -0.727655 2.238253
H -4.206036 -1.897733 1.427759
H -2.438130 -2.202285 1.478857
H -3.153159 -1.038114 -2.125309
H -4.208460 -2.096360 -1.137903
H -2.437943 -2.383314 -1.177064
H 0.696354 0.948272 -0.994032
H 0.876184 0.899170 0.770083
H 1.811402 -1.551749 0.379761
H 2.088656 -1.052988 -1.280769
H 6.417819 -0.698366 -0.494063
H 5.804823 -0.136745 1.120902
H 5.774790 0.987374 -0.280389


