%chk=000196512.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196512

0 1
O 1.885527 -1.185048 -0.504012
O 0.148484 -0.160463 0.538278
O 3.723027 2.465212 -0.847518
O 0.964604 2.119880 -1.454238
O 4.941167 -0.496773 -1.222896
O 2.656460 -1.903491 2.407080
O 2.767788 0.334256 2.306432
O -1.563470 -2.490505 1.160442
N -5.305263 0.144748 -0.393349
C 3.166443 1.170490 -1.104889
C 1.724105 1.290654 -0.568080
C 3.984671 0.094551 -0.352536
C 0.994264 -0.067733 -0.623748
C 3.085280 -1.012865 0.250736
C 2.804939 -0.722423 1.729112
C -1.225392 -0.172525 0.254127
C -1.794669 0.970376 -0.295470
C -2.008435 -1.313433 0.621145
C -3.180835 0.999171 -0.485084
C -3.966593 -0.147428 -0.102517
C -3.394682 -1.303780 0.448688
C -4.096408 1.981456 -1.011895
C -5.367361 1.448976 -0.946571
C -0.142204 -2.663532 1.389391
H 3.172474 0.985488 -2.203437
H 1.710834 1.727274 0.463589
H 4.629039 0.574707 0.430474
H 0.448745 -0.264203 -1.571568
H 3.562153 -2.025430 0.141074
H 4.624804 2.533080 -1.234965
H 1.355467 3.030132 -1.456768
H 4.505101 -0.983318 -1.959960
H -1.166898 1.821333 -0.575810
H -3.986520 -2.166826 0.734321
H 2.479253 -1.767653 3.381424
H -3.813519 2.946880 -1.380962
H -6.086895 -0.458643 -0.233089
H -6.307279 1.879338 -1.243195
H 0.403079 -2.628204 0.438831
H -0.109073 -3.660760 1.841019
H 0.226585 -1.891570 2.072793


%chk=000196512-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000196512

0 1
O 1.873586 -1.122553 -0.630319
O 0.093885 -0.110733 0.620888
O 3.742965 2.552289 -1.107760
O 0.989168 2.423353 -0.967895
O 5.134841 -0.224271 -1.321966
O 2.925475 -2.368768 2.050278
O 3.031599 -0.067031 2.338213
O -1.700420 -2.407315 1.438873
N -5.384710 0.113444 -0.571310
C 3.132789 1.220479 -1.118143
C 1.799233 1.362184 -0.370059
C 4.031138 0.172564 -0.433912
C 0.989977 0.057717 -0.511501
C 3.190879 -1.044352 0.051551
C 3.036290 -1.060887 1.581107
C -1.313229 -0.142935 0.323682
C -1.879447 0.958036 -0.348235
C -2.119168 -1.252774 0.760286
C -3.266595 0.969736 -0.627692
C -4.063157 -0.146343 -0.189029
C -3.509963 -1.240533 0.499950
C -4.160860 1.903793 -1.282791
C -5.439627 1.353842 -1.232087
C -0.307647 -2.597630 1.864979
H 2.931350 0.902886 -2.166237
H 1.994980 1.571490 0.700138
H 4.537914 0.649356 0.421218
H 0.412607 0.062184 -1.453316
H 3.689959 -1.980622 -0.246798
H 4.638748 2.502807 -1.527038
H 1.568396 3.227759 -1.027349
H 4.758672 -0.650845 -2.135788
H -1.225262 1.790997 -0.629591
H -4.102051 -2.094225 0.842662
H 2.801082 -2.360339 3.039035
H -3.893695 2.858382 -1.732047
H -6.178419 -0.498180 -0.397513
H -6.382537 1.743485 -1.611591
H 0.377181 -2.654245 1.003742
H -0.323575 -3.558644 2.404269
H 0.016446 -1.782160 2.535494


