%chk=000265298.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265298

0 1
O 1.958136 0.885535 -0.976365
O 2.893556 2.015344 1.883735
O 4.458517 0.237173 1.050799
O 2.631598 -1.555727 -2.656283
N -0.071639 0.763506 0.240642
N -2.312815 0.453726 -0.327370
N -1.196135 2.472094 -1.187262
N 0.282065 -1.436567 1.414431
N -1.743186 -2.808819 1.502703
N -3.806616 -2.118442 0.569677
C 1.287719 1.335024 0.205198
C 2.158181 0.897592 1.420595
C 3.106354 -0.195699 0.848440
C 2.906561 -0.183132 -0.681076
C 2.352054 -1.492299 -1.255631
C -0.454197 -0.505635 0.725643
C -1.255060 1.282562 -0.439474
C -1.837776 -0.665705 0.387922
C -2.481092 -1.865746 0.807155
C -2.494195 3.156174 -1.458706
C -0.430193 -2.547034 1.766416
C -3.039555 3.920471 -0.256881
H 1.226331 2.444444 0.088979
H 1.567572 0.572936 2.305625
H 2.942777 -1.186393 1.318845
H 3.833141 0.135462 -1.218643
H 1.263865 -1.589104 -1.087532
H 2.877554 -2.379971 -0.853313
H 3.708174 2.152976 1.320028
H 4.712022 0.121673 1.995977
H -0.456521 3.119474 -0.898062
H 2.138261 -0.845089 -3.126297
H -2.309127 3.841999 -2.317475
H -3.236028 2.397024 -1.806364
H 0.115208 -3.327145 2.324730
H -3.250576 3.245763 0.585070
H -2.350368 4.692704 0.100523
H -3.984586 4.419687 -0.505831
H -4.348191 -1.480263 0.006640
H -4.216489 -3.000172 0.834290


%chk=000265298-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000265298

0 1
O 1.964727 1.225957 -0.863034
O 3.050936 1.940639 1.892782
O 4.475192 -0.166367 1.150631
O 2.316593 -0.614877 -3.031029
N -0.059625 0.652016 0.363032
N -2.307181 0.435131 -0.158129
N -1.103389 2.345710 -1.039298
N 0.230201 -1.484430 1.640208
N -1.868773 -2.745192 1.829449
N -3.899010 -1.996513 0.869397
C 1.235091 1.337472 0.420120
C 2.208666 0.819890 1.495366
C 3.059974 -0.260341 0.743797
C 2.958952 0.106551 -0.755253
C 2.488517 -1.052584 -1.646358
C -0.491896 -0.563353 0.940747
C -1.192826 1.185339 -0.312364
C -1.873311 -0.651392 0.625345
C -2.562456 -1.798825 1.106657
C -2.303933 2.947806 -1.654405
C -0.539191 -2.544054 2.049862
C -3.156887 3.744164 -0.645694
H 1.055488 2.414876 0.574443
H 1.690944 0.397662 2.372646
H 2.638949 -1.258694 0.959963
H 3.917064 0.512878 -1.121022
H 1.549192 -1.485184 -1.240439
H 3.260395 -1.840838 -1.678018
H 3.995804 1.628361 1.793611
H 4.656333 -0.804890 1.884313
H -0.179907 2.671158 -1.324752
H 1.727570 0.183669 -3.012169
H -1.960654 3.605670 -2.473062
H -2.915076 2.140965 -2.099726
H -0.024545 -3.321183 2.622571
H -3.510596 3.079268 0.160656
H -2.576316 4.568912 -0.196084
H -4.041405 4.174210 -1.150686
H -4.422666 -1.312200 0.328687
H -4.345646 -2.836987 1.228735


