%chk=000275944.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275944

0 1
O 1.847150 1.686979 0.828329
O 3.604275 0.213324 0.599821
O 4.303993 -2.651355 -0.570439
N -0.970378 -0.369239 0.057769
N -2.535582 -1.795183 0.962598
N -2.537998 1.370176 -0.851244
N -4.886251 0.840207 -0.395604
N -5.574797 -1.103651 0.759917
C 1.255305 0.383685 0.894940
C 2.437870 -0.613294 0.767548
C 0.336324 0.181037 -0.344568
C 2.167904 -1.497309 -0.471881
C 1.086310 -0.775812 -1.297519
C 3.230920 1.602270 0.389567
C 3.435610 -1.772628 -1.294823
C 3.330201 1.956709 -1.081494
C 4.061894 2.451414 1.327065
C -2.220247 0.204302 -0.196290
C -1.228866 -1.592151 0.763355
C -3.185802 -0.697175 0.378549
C -4.562166 -0.331959 0.256412
C -3.873372 1.613555 -0.905496
H 0.714530 0.366659 1.860501
H 2.651724 -1.204286 1.678169
H 0.157195 1.182411 -0.833561
H 1.776027 -2.482277 -0.115418
H 1.541077 -0.184380 -2.117842
H 0.406089 -1.493071 -1.790464
H 3.976269 -0.840634 -1.542485
H 3.209007 -2.343533 -2.214551
H 2.953214 2.971701 -1.266020
H 4.367482 1.911681 -1.434460
H 2.737668 1.272879 -1.703618
H 3.768943 3.507809 1.272596
H 3.926378 2.130423 2.370097
H 5.131495 2.374077 1.097232
H -0.426562 -2.244626 1.076502
H 4.727594 -2.159543 0.168684
H -4.191786 2.538401 -1.417843
H -6.536797 -0.818885 0.664095
H -5.367145 -1.962107 1.246272


%chk=000275944-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000275944

0 1
O 2.025505 1.854745 0.000980
O 3.627338 0.156537 0.055059
O 4.155468 -2.525255 -0.627731
N -1.002140 -0.256604 0.077569
N -2.373020 -1.556479 1.392778
N -2.733090 1.072791 -1.110255
N -5.011750 0.461416 -0.407632
N -5.458050 -1.205619 1.207549
C 1.295227 0.665146 0.484611
C 2.346695 -0.499195 0.432374
C 0.197014 0.329931 -0.557691
C 1.885212 -1.470714 -0.692205
C 0.901828 -0.631886 -1.552495
C 3.462688 1.622463 0.267521
C 3.065007 -2.069751 -1.495327
C 4.271818 2.361887 -0.790159
C 3.820191 1.990515 1.716498
C -2.316872 0.122736 -0.224662
C -1.102626 -1.266300 1.050840
C -3.144312 -0.690094 0.595983
C -4.551495 -0.487946 0.474812
C -4.095942 1.174877 -1.134721
H 0.881575 0.852138 1.493280
H 2.483484 -1.005948 1.404309
H -0.151916 1.253656 -1.049940
H 1.341873 -2.305118 -0.206182
H 1.473250 -0.015036 -2.272208
H 0.180505 -1.240745 -2.122179
H 3.432565 -1.318397 -2.224439
H 2.737056 -2.967166 -2.046478
H 4.116253 3.449361 -0.692344
H 5.346269 2.145500 -0.667332
H 3.952739 2.045101 -1.795838
H 3.642783 3.066008 1.887592
H 3.208133 1.416772 2.434351
H 4.882974 1.767936 1.912088
H -0.229798 -1.750398 1.482742
H 4.579807 -1.707762 -0.254151
H -4.512440 1.918850 -1.820208
H -6.450945 -1.019745 1.082570
H -5.134161 -1.911606 1.865065


