%chk=000215941.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215941

0 1
O 3.570354 1.639649 2.503921
O 1.418665 1.024767 0.783831
O -4.701561 0.044743 0.561977
O -4.509957 0.727946 -1.577653
N 4.526240 -0.601266 -0.258327
N -0.544802 -0.263407 0.888383
C 4.201767 0.726963 0.345088
C 3.524381 0.451415 1.706701
C 4.194260 -0.650230 -1.720632
C 5.956898 -0.977110 0.001436
C 2.080668 -0.044269 1.560895
C 2.678579 -0.703367 -1.913599
C 6.134184 -2.488057 -0.154347
C 0.109711 0.865298 0.479672
C -1.836468 1.775533 -0.594006
C -0.487679 1.904017 -0.263504
C -2.546193 0.619576 -0.166946
C -1.864856 -0.383416 0.568692
C -2.515756 2.846857 -1.369758
C -2.527820 -1.639518 1.015060
C -3.966017 0.484185 -0.521630
C -6.135397 -0.169696 0.371504
C -6.368980 -1.491459 -0.330757
H 5.085346 1.379926 0.506653
H 3.507933 1.308027 -0.302328
H 4.112568 -0.276855 2.317152
H 4.623715 0.204614 -2.286318
H 4.648797 -1.573408 -2.146931
H 6.210886 -0.687918 1.046199
H 6.670045 -0.437466 -0.658446
H 1.556317 -0.136403 2.526400
H 2.017568 -0.986624 0.985421
H 2.249307 -1.586359 -1.422097
H 2.176448 0.172422 -1.480139
H 2.417833 -0.749318 -2.975441
H 5.383433 -3.033757 0.433476
H 6.017691 -2.810752 -1.195288
H 7.124910 -2.804524 0.187290
H 2.962560 2.321421 2.143551
H 0.098630 2.768350 -0.557978
H -3.124978 2.426971 -2.195404
H -3.214021 3.417963 -0.737636
H -1.819075 3.567203 -1.817340
H -2.840781 -2.253097 0.157280
H -1.869229 -2.261844 1.642461
H -3.438022 -1.419009 1.603112
H -6.549683 0.687159 -0.189599
H -6.487252 -0.161973 1.419082
H -7.435421 -1.743624 -0.365619
H -5.845596 -2.314950 0.169722
H -6.005951 -1.456030 -1.369436


%chk=000215941-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000215941

0 1
O 3.645270 1.965768 2.310533
O 1.437895 1.237720 0.755492
O -4.736792 -0.143652 0.641469
O -4.611257 0.872986 -1.448426
N 4.533716 -0.613223 -0.327452
N -0.489004 -0.120388 0.863415
C 4.339107 0.733969 0.265557
C 3.601307 0.661629 1.626928
C 4.397112 -0.636357 -1.809235
C 5.776531 -1.273829 0.157713
C 2.162505 0.159354 1.494122
C 2.934961 -0.508004 -2.278359
C 5.704589 -2.811926 0.103639
C 0.095820 1.034728 0.475610
C -1.947912 1.900839 -0.510279
C -0.582063 2.065009 -0.217714
C -2.595054 0.690319 -0.072045
C -1.820797 -0.306317 0.601733
C -2.681001 3.003728 -1.247119
C -2.361823 -1.647450 1.054983
C -4.038698 0.492964 -0.393439
C -6.186557 -0.417164 0.392157
C -6.372851 -1.736997 -0.362716
H 5.301950 1.269410 0.432118
H 3.737932 1.354558 -0.422934
H 4.142505 -0.025181 2.302541
H 5.019552 0.161902 -2.287706
H 4.797944 -1.601735 -2.168479
H 5.933020 -0.964977 1.208470
H 6.673285 -0.915730 -0.408970
H 1.679888 0.021965 2.476593
H 2.122671 -0.778962 0.916723
H 2.331511 -1.342612 -1.879806
H 2.473455 0.435524 -1.935018
H 2.880126 -0.528301 -3.382919
H 4.851974 -3.174230 0.704325
H 5.574264 -3.183544 -0.928801
H 6.635319 -3.256263 0.503371
H 2.964631 2.543465 1.876582
H -0.043364 2.969052 -0.512097
H -3.024313 2.654586 -2.235632
H -3.590392 3.320450 -0.705487
H -2.027399 3.882120 -1.378610
H -2.980053 -2.129932 0.278776
H -1.510357 -2.297494 1.308288
H -3.004991 -1.529623 1.944050
H -6.611288 0.430138 -0.174129
H -6.617470 -0.454020 1.405424
H -7.451799 -1.954901 -0.469832
H -5.905444 -2.575022 0.182980
H -5.933963 -1.675055 -1.372587


