%chk=000255019.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255019

0 1
O 5.438022 -1.369409 -0.307628
O 5.612515 1.310226 0.303105
N 3.686209 0.065859 0.115228
N -1.966962 0.444342 0.498309
N -2.726928 -0.223129 -0.242593
C 2.236821 0.129569 0.162322
C 1.465304 -0.152381 -0.988248
C 1.622172 0.480181 1.377162
C 0.068981 -0.082478 -0.888592
C -0.542473 0.271785 0.324182
C 0.235283 0.558700 1.462650
C 2.094854 -0.536137 -2.284624
C 4.324914 -1.236745 0.134069
C 4.439653 1.299571 0.025442
C 3.496754 -2.348022 0.703685
C 3.654517 2.505883 -0.392028
C -4.150908 -0.042997 -0.091425
C -4.762366 1.010730 0.612735
C -4.934365 -1.011015 -0.750232
C -6.155238 1.091044 0.654190
C -6.325790 -0.918134 -0.695258
C -6.936339 0.129577 0.003559
H 2.236713 0.691076 2.254087
H -0.551584 -0.305503 -1.760081
H -0.250319 0.836487 2.399878
H 3.099278 -0.105316 -2.415944
H 2.208581 -1.628632 -2.361395
H 1.496959 -0.216076 -3.149633
H 3.121683 -2.114877 1.710964
H 2.622563 -2.581342 0.079079
H 4.099381 -3.267691 0.781432
H 2.935096 2.819219 0.378687
H 4.333781 3.356230 -0.567251
H 3.085591 2.341143 -1.318265
H -4.148683 1.756875 1.120768
H -4.451190 -1.823543 -1.295079
H -6.634537 1.905473 1.196621
H -6.938255 -1.664585 -1.200142
H -8.023188 0.196741 0.040467


%chk=000255019-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000255019

0 1
O 5.545123 -1.361367 -0.107408
O 5.653939 1.411616 -0.042240
N 3.689456 0.096838 0.076402
N -1.983002 0.349567 0.613465
N -2.715688 -0.057512 -0.392320
C 2.241030 0.140086 0.172158
C 1.439639 -0.308845 -0.924765
C 1.641961 0.634556 1.354084
C 0.037710 -0.247109 -0.794288
C -0.569703 0.248555 0.393847
C 0.241059 0.692165 1.470179
C 2.081795 -0.833510 -2.194965
C 4.367241 -1.169822 0.268506
C 4.415790 1.318970 -0.199487
C 3.546917 -2.249351 0.968417
C 3.565838 2.495379 -0.671711
C -4.129241 0.039335 -0.181217
C -4.744953 0.523043 1.009305
C -4.930395 -0.392927 -1.271397
C -6.148258 0.568133 1.093379
C -6.336901 -0.343676 -1.178428
C -6.948675 0.136563 0.003414
H 2.285133 0.966449 2.176558
H -0.614547 -0.575418 -1.609834
H -0.247015 1.069050 2.374174
H 2.863179 -0.149462 -2.573059
H 2.579621 -1.808351 -2.029652
H 1.328797 -0.973892 -2.987645
H 3.159625 -1.892301 1.938675
H 2.675313 -2.563375 0.366730
H 4.202838 -3.117767 1.127802
H 2.997858 2.936141 0.167296
H 4.248739 3.260060 -1.070851
H 2.834139 2.202730 -1.443957
H -4.108049 0.850423 1.836544
H -4.426806 -0.759530 -2.171968
H -6.628483 0.938741 2.005877
H -6.953432 -0.677025 -2.019914
H -8.041092 0.175538 0.078498


