%chk=000281617.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281617

0 1
O -0.379643 -2.736144 1.869589
O 0.382695 -2.742967 -1.947508
O 3.893159 0.240581 -0.414208
O -3.911932 0.214109 0.320330
O 2.094603 1.599882 0.019711
O -2.122936 1.584168 -0.119211
N 1.891069 -0.732026 -0.009196
N -1.902625 -0.746050 -0.078753
N -0.030866 0.926671 2.381668
N 0.007190 0.914602 -2.477966
C 0.523951 -0.858291 0.545957
C -0.534606 -0.865155 -0.633322
C 0.548538 -2.265410 1.279713
C -0.548953 -2.276052 -1.360072
C 2.627338 -2.035795 0.030820
C -2.629451 -2.055256 -0.112438
C 1.908557 -2.883509 1.085556
C -1.904509 -2.902938 -1.163006
C 0.213818 0.161158 1.554860
C -0.231927 0.151473 -1.647334
C 2.574240 0.498780 -0.099124
C -2.594708 0.480243 0.004728
C 4.734861 1.418843 -0.674468
C -4.762157 1.387506 0.574650
C 5.069263 2.118493 0.622983
C -5.100687 2.078885 -0.726179
H 2.559283 -2.496919 -0.984741
H 3.702654 -1.877066 0.263046
H -2.558176 -2.510913 0.905358
H -3.705894 -1.905471 -0.345515
H 1.826327 -3.947192 0.782970
H 2.456438 -2.901175 2.052129
H -1.814746 -3.964517 -0.855298
H -2.452166 -2.929121 -2.129541
H 5.603554 0.928474 -1.151674
H 4.204176 2.072176 -1.390900
H -4.236585 2.047847 1.288424
H -5.627694 0.893181 1.053517
H 5.803711 2.918732 0.469134
H 4.172373 2.583395 1.066477
H 5.478292 1.427139 1.369661
H -5.840335 2.875077 -0.576261
H -4.206677 2.547527 -1.171547
H -5.505017 1.381425 -1.469720


%chk=000281617-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000281617

0 1
O -0.143152 -3.393124 1.573034
O 0.150641 -3.399028 -1.648947
O 3.632084 0.546349 -0.405083
O -3.652849 0.522101 0.310404
O 1.609325 1.477300 0.365201
O -1.636837 1.464103 -0.464088
N 1.908075 -0.841902 0.169451
N -1.918339 -0.856246 -0.256246
N -0.477373 0.099879 2.653224
N 0.454968 0.092960 -2.746139
C 0.561875 -1.210832 0.582805
C -0.569617 -1.217493 -0.668087
C 0.772697 -2.701559 1.087765
C -0.770021 -2.711806 -1.166640
C 2.774973 -2.023758 -0.104316
C -2.776610 -2.043040 0.023375
C 2.222265 -3.096717 0.855717
C -2.216517 -3.116497 -0.931817
C 0.013982 -0.416807 1.697809
C -0.027284 -0.424447 -1.786485
C 2.317735 0.488757 0.065560
C -2.337839 0.471867 -0.159271
C 4.186427 1.928690 -0.559064
C -4.217733 1.901002 0.456620
C 4.755464 2.443966 0.764615
C -4.788749 2.405445 -0.870373
H 2.671804 -2.342187 -1.156878
H 3.822082 -1.752798 0.085975
H -2.670757 -2.355763 1.077381
H -3.825712 -1.780542 -0.167776
H 2.276212 -4.124963 0.463691
H 2.746312 -3.072613 1.831254
H -2.262631 -4.143205 -0.534785
H -2.741239 -3.100983 -1.907152
H 4.963740 1.802829 -1.329310
H 3.380275 2.582359 -0.934341
H -3.417024 2.562555 0.829752
H -4.995165 1.773164 1.226419
H 5.232712 3.428495 0.603013
H 3.953879 2.570265 1.511255
H 5.518568 1.753795 1.164746
H -5.273872 3.387003 -0.714224
H -3.987076 2.534364 -1.616466
H -5.545896 1.707461 -1.268277


